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gepirone

PropertiesImage
MNX_IDMNXM525846 Image of MNXM525846
referencechebi:135990
formulaC19H29N5O2
global charge0
mol weight359.474
InChIKeyQOIGKGMMAGJZNZ-UHFFFAOYSA-N
InChIInChI=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
SMILESCC1(C)CC(=O)N(CCCCN2CCN(c3ncccn3)CC2)C(=O)C1
MNX internals
InChI (mnx)InChI=1/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 Image of MNXM525846
SMILES (mnx)[CH3:1][C:19]1([CH3:2])[CH2:14][C:16](=[O:25])[N:24]([CH2:9][CH2:4][CH2:3][CH2:8][N:22]2[CH2:10][CH2:12][N:23]([c:18]3[n:20][cH:6][cH:5][cH:7][n:21]3)[CH2:13][CH2:11]2)[C:17](=[O:26])[CH2:15]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:135990
chebi:135990
QOIGKGMMAGJZNZ-UHFFFAOYSA-N 		gepirone
4,4-dimethyl-1-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-2,6-piperidinedione
4,4-dimethyl-1-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}piperidine-2,6-dione
gepirona
gepironum

vmhM:geprn
vmhM:geprn
vmhmetabolite:geprn
vmhmetabolite:geprn
QOIGKGMMAGJZNZ-UHFFFAOYSA-O 		Gepirone
hmdb:HMDB0252698
QOIGKGMMAGJZNZ-UHFFFAOYSA-N 		Gepirone
4,4-Dimethyl-1-(4-(4-(2-pyrimidinyl)-1-piperazinyl)butyl)-2,6-piperidinedione
4,4-dimethyl-1-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}piperidine-2,6-dione
Ariza
BMY-13805gepirone
Gepirone monohydrochloride
ORG-13011variza
gepirone

CHEBI:229647
chebi:229647
QOIGKGMMAGJZNZ-UHFFFAOYSA-O 		gepirone(1+)
1-[4-(4,4-dimethyl-2,6-dioxopiperidin-1-yl)butyl]-4-(pyrimidin-2-yl)piperazin-1-ium
gepirone cation

vmhM:M_geprn 		secondary/obsolete/fantasy identifier