methylphenidate hydrochloride (Q26840773)

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chemical compound

• methyl 2-phenyl-2-piperidin-2-yl-ethanoate;hydrochloride
• methyl 2-phenyl-2-(2-piperidyl)acetate;hydrochloride
• 2-phenyl-2-(2-piperidinyl)acetic acid methyl ester;hydrochloride
• methyl 2-phenyl-2-piperidin-2-ylacetate;hydrochloride
• methylphenidylacetate hydrochloride
• methylphenidate HCl

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Language	Label	Description	Also known as
English	methylphenidate hydrochloride	chemical compound	methyl 2-phenyl-2-piperidin-2-yl-ethanoate;hydrochloride methyl 2-phenyl-2-(2-piperidyl)acetate;hydrochloride 2-phenyl-2-(2-piperidinyl)acetic acid methyl ester;hydrochloride methyl 2-phenyl-2-piperidin-2-ylacetate;hydrochloride methylphenidylacetate hydrochloride methylphenidate HCl

Statements

instance of

group of stereoisomers

0 references

subclass of

carboxylate ester

0 references

substituted benzene

0 references

hydrochloride

0 references

piperidine

0 references

mass

269.118±0 dalton

1 reference

stated in

PubChem

PubChem CID

9280

language of work or name

English

title

METHYLPHENIDATE HYDROCHLORIDE (English)

retrieved

6 October 2016

chemical formula

C₁₄H₂₀ClNO₂

1 reference

stated in

PubChem

PubChem CID

9280

language of work or name

English

title

METHYLPHENIDATE HYDROCHLORIDE (English)

retrieved

6 October 2016

canonical SMILES

COC(=O)C(C1CCCCN1)C2=CC=CC=C2.Cl

1 reference

stated in

PubChem

PubChem CID

9280

language of work or name

English

title

METHYLPHENIDATE HYDROCHLORIDE (English)

retrieved

6 October 2016

physically interacts with

solute carrier family 6 member 3

subject has role

reaction inhibitor

1 reference

stated in

Open Targets Platform

retrieved

14 August 2023

reference URL

https://platform.opentargets.org/drug/CHEMBL1722

Solute carrier family 6 member 2

subject has role

reaction inhibitor

1 reference

stated in

Open Targets Platform

retrieved

14 August 2023

reference URL

https://platform.opentargets.org/drug/CHEMBL1722

legal status (medicine)

boxed warning

1 reference

reference URL

https://nctr-crs.fda.gov/fdalabel/ui/spl-summaries/criteria/343802

title

FDA-sourced list of all drugs with black box warnings (Use Download Full Results and View Query links. (English)

Identifiers

InChI

InChI=1S/C14H19NO2.ClH/c1-17-14(16)13(11-7-3-2-4-8-11)12-9-5-6-10-15-12;/h2-4,7-8,12-13,15H,5-6,9-10H2,1H3;1H

1 reference

stated in

PubChem

PubChem CID

9280

language of work or name

English

title

METHYLPHENIDATE HYDROCHLORIDE (English)

retrieved

6 October 2016

InChIKey

JUMYIBMBTDDLNG-UHFFFAOYSA-N

2 references

stated in

PubChem

PubChem CID

9280

language of work or name

English

title

METHYLPHENIDATE HYDROCHLORIDE (English)

retrieved

6 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

298-59-9

2 references

stated in

ChEBI

ChEBI ID

31836

language of work or name

English

title

methylphenidate hydrochloride (English)

retrieved

6 October 2016

InChIKey

JUMYIBMBTDDLNG-UHFFFAOYSA-N

stated in

CAS Common Chemistry

retrieved

8 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=298-59-9

ChemSpider ID

8923

1 reference

stated in

ChemSpider

ChemSpider ID

8923

language of work or name

English

title

Ritalin hydrochloride (English)

retrieved

6 October 2016

PubChem CID

9280

2 references

stated in

PubChem

PubChem CID

9280

language of work or name

English

title

METHYLPHENIDATE HYDROCHLORIDE (English)

retrieved

6 October 2016

matched by identifier from

InChIKey

InChIKey

JUMYIBMBTDDLNG-UHFFFAOYSA-N

10945497

1 reference

matched by identifier from

InChIKey

InChIKey

JUMYIBMBTDDLNG-UHFFFAOYSA-N

57516065

1 reference

matched by identifier from

InChIKey

InChIKey

JUMYIBMBTDDLNG-UHFFFAOYSA-N

Reaxys registry number

6492989

1 reference

stated in

ChEBI

ChEBI ID

31836

language of work or name

English

title

methylphenidate hydrochloride (English)

retrieved

6 October 2016

ChEBI ID

31836

mapping relation type

exact match

2 references

stated in

ChEBI

ChEBI ID

31836

language of work or name

English

title

methylphenidate hydrochloride (English)

retrieved

6 October 2016

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C14H19NO2.ClH/c1-17-14(16)13(11-7-3-2-4-8-11)12-9-5-6-10-15-12;/h2-4,7-8,12-13,15H,5-6,9-10H2,1H3;1H

ChEMBL ID

CHEMBL1722

1 reference

stated in

ChEMBL

ChEMBL ID

CHEMBL1722

language of work or name

English

title

METHYLPHENIDATE HYDROCHLORIDE (English)

retrieved

6 October 2016

SureChEMBL ID

SCHEMBL157098

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

JUMYIBMBTDDLNG-UHFFFAOYSA-N

SCHEMBL41067

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

JUMYIBMBTDDLNG-UHFFFAOYSA-N

CAMEO Chemicals ID

20687

0 references

DSSTox substance ID

DTXSID8020886

2 references

stated in

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

matched by identifier from

InChIKey

InChIKey

JUMYIBMBTDDLNG-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID20886

0 references

NSC number

169868

0 references

759278

0 references

EC number

206-065-3

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.005.515

retrieved

27 December 2018

title

Methylphenidate hydrochloride (English)

quotation

CAS no.: 298-59-9 (English)

ECHA Substance Infocard ID

100.005.515

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.005.515

retrieved

27 December 2018

title

Methylphenidate hydrochloride (English)

quotation

CAS no.: 298-59-9 (English)

UNII

4B3SC438HI

0 references

Probes And Drugs ID

PD000268

0 references

KEGG ID

D01296

1 reference

stated in

ChEBI

ChEBI ID

31836

language of work or name

English

title

methylphenidate hydrochloride (English)

retrieved

6 October 2016

 

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