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A1B46

Summary
Name:(3S)-1-[(6-ethenylpyridin-2-yl)acetyl]piperidine-3-carboxamide
Formula:C15 H19 N3 O2
Formal charge:0
Formula weight:273.33 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.52(3S)-1-[(6-ethenylpyridin-2-yl)acetyl]piperidine-3-carboxamide
OpenEye OEToolkits3.1.0.0(3~{S})-1-[2-(6-ethenylpyridin-2-yl)ethanoyl]piperidine-3-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52O=C(Cc1cccc(C=C)n1)N1CCCC(C1)C(N)=O
InChIInChI1.06InChI=1S/C15H19N3O2/c1-2-12-6-3-7-13(17-12)9-14(19)18-8-4-5-11(10-18)15(16)20/h2-3,6-7,11H,1,4-5,8-10H2,(H2,16,20)/t11-/m0/s1
InChIKeyInChI1.06BMEGHVOHSIRYBH-NSHDSACASA-N
SMILES_CANONICALCACTVS3.385NC(=O)[C@H]1CCCN(C1)C(=O)Cc2cccc(C=C)n2
SMILESCACTVS3.385NC(=O)[CH]1CCCN(C1)C(=O)Cc2cccc(C=C)n2
SMILES_CANONICALOpenEye OEToolkits3.1.0.0C=Cc1cccc(n1)CC(=O)N2CCC[C@@H](C2)C(=O)N
SMILESOpenEye OEToolkits3.1.0.0C=Cc1cccc(n1)CC(=O)N2CCCC(C2)C(=O)N

248636

PDB entries from 2026-02-04

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