gepirone (CHEBI:135990)

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ChEBI Name	gepirone

ChEBI ID	CHEBI:135990

Definition	A member of the class of piperidones that is piperidine-2,6-dione substituted by a 4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl group at position 1 and two methyl groups at position 4.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C19H29N5O2

Net Charge

Average Mass

359.474

Monoisotopic Mass

359.23213

InChI

InChI=1S/C19H29N5O2/c1-19(2)14-16(25)24(17(26)15-19)9-4-3-8-22-10-12-23(13-11-22)18-20-6-5-7-21-18/h5-7H,3-4,8-15H2,1-2H3

InChIKey

QOIGKGMMAGJZNZ-UHFFFAOYSA-N

SMILES

CC1(C)CC(=O)N(CCCCN2CCN(CC2)C2=NC=CC=N2)C(=O)C1

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	serotonergic agonist An agent that has an affinity for serotonin receptors and is able to mimic the effects of serotonin by stimulating the physiologic activity at the cell receptors. Serotonin agonists are used as antidepressants, anxiolytics, and in the treatment of migraine disorders.

Application(s):	serotonergic agonist An agent that has an affinity for serotonin receptors and is able to mimic the effects of serotonin by stimulating the physiologic activity at the cell receptors. Serotonin agonists are used as antidepressants, anxiolytics, and in the treatment of migraine disorders. antidepressant Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions. anxiolytic drug Anxiolytic drugs are agents that alleviate anxiety, tension, and anxiety disorders, promote sedation, and have a calming effect without affecting clarity of consciousness or neurologic conditions.

ChEBI Ontology
Outgoing	gepirone (CHEBI:135990) has role antidepressant (CHEBI:35469) gepirone (CHEBI:135990) has role anxiolytic drug (CHEBI:35474) gepirone (CHEBI:135990) has role serotonergic agonist (CHEBI:35941) gepirone (CHEBI:135990) is a N-alkylpiperazine (CHEBI:46845) gepirone (CHEBI:135990) is a piperidones (CHEBI:48589) gepirone (CHEBI:135990) is a pyrimidines (CHEBI:39447) gepirone (CHEBI:135990) is conjugate base of gepirone(1+) (CHEBI:229647)

Incoming	gepirone(1+) (CHEBI:229647) is conjugate acid of gepirone (CHEBI:135990)

IUPAC Name

4,4-dimethyl-1-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}piperidine-2,6-dione

Synonym	Source
4,4-dimethyl-1-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-2,6-piperidinedione	ChEBI

Registry Number	Type	Source
83928-76-1	CAS Registry Number	DrugBank

Last Modified

16 April 2024