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5WZ

Summary
Name:(4-azanylpiperidin-1-yl)-cyclopropyl-methanone
Formula:C9 H16 N2 O
Formal charge:0
Formula weight:168.236 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.4(4-azanylpiperidin-1-yl)-cyclopropyl-methanone

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C9H16N2O/c10-8-3-5-11(6-4-8)9(12)7-1-2-7/h7-8H,1-6,10H2
InChIKeyInChI1.03GCYSQXZPDQBVCH-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NC1CCN(CC1)C(=O)C2CC2
SMILESCACTVS3.385NC1CCN(CC1)C(=O)C2CC2
SMILES_CANONICALOpenEye OEToolkits2.0.4C1CC1C(=O)N2CCC(CC2)N
SMILESOpenEye OEToolkits2.0.4C1CC1C(=O)N2CCC(CC2)N

224201

PDB entries from 2024-08-28

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