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A1B15

Summary
Name:(3S)-1-[(5-methyl-1H-indol-1-yl)acetyl]piperidine-3-carboxamide
Formula:C17 H21 N3 O2
Formal charge:0
Formula weight:299.368 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.52(3S)-1-[(5-methyl-1H-indol-1-yl)acetyl]piperidine-3-carboxamide
OpenEye OEToolkits3.1.0.0(3~{S})-1-[2-(5-methylindol-1-yl)ethanoyl]piperidine-3-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52O=C(Cn1ccc2cc(C)ccc21)N1CCCC(C1)C(N)=O
InChIInChI1.06InChI=1S/C17H21N3O2/c1-12-4-5-15-13(9-12)6-8-19(15)11-16(21)20-7-2-3-14(10-20)17(18)22/h4-6,8-9,14H,2-3,7,10-11H2,1H3,(H2,18,22)/t14-/m0/s1
InChIKeyInChI1.06YRQRTFXUBOFTEB-AWEZNQCLSA-N
SMILES_CANONICALCACTVS3.385Cc1ccc2n(CC(=O)N3CCC[C@@H](C3)C(N)=O)ccc2c1
SMILESCACTVS3.385Cc1ccc2n(CC(=O)N3CCC[CH](C3)C(N)=O)ccc2c1
SMILES_CANONICALOpenEye OEToolkits3.1.0.0Cc1ccc2c(c1)ccn2CC(=O)N3CCC[C@@H](C3)C(=O)N
SMILESOpenEye OEToolkits3.1.0.0Cc1ccc2c(c1)ccn2CC(=O)N3CCCC(C3)C(=O)N

248636

PDB entries from 2026-02-04

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