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A1CUW

Summary
Name:2-(2-fluorophenyl)-N-[(1R,3s,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]acetamide
Formula:C16 H21 F N2 O
Formal charge:0
Formula weight:276.349 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.522-(2-fluorophenyl)-N-[(1R,3s,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]acetamide
OpenEye OEToolkits3.1.0.02-(2-fluorophenyl)-~{N}-[(1~{S},5~{R})-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]ethanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52CN1C2CCC1CC(C2)NC(=O)Cc1ccccc1F
InChIInChI1.06InChI=1S/C16H21FN2O/c1-19-13-6-7-14(19)10-12(9-13)18-16(20)8-11-4-2-3-5-15(11)17/h2-5,12-14H,6-10H2,1H3,(H,18,20)/t12-,13-,14+
InChIKeyInChI1.06WSKHBFGUDAWDLB-ZSOGYDGISA-N
SMILES_CANONICALCACTVS3.385CN1[C@H]2CC[C@@H]1C[C@H](C2)NC(=O)Cc3ccccc3F
SMILESCACTVS3.385CN1[CH]2CC[CH]1C[CH](C2)NC(=O)Cc3ccccc3F
SMILES_CANONICALOpenEye OEToolkits3.1.0.0CN1[C@@H]2CC[C@H]1CC(C2)NC(=O)Cc3ccccc3F
SMILESOpenEye OEToolkits3.1.0.0CN1C2CCC1CC(C2)NC(=O)Cc3ccccc3F

249697

PDB entries from 2026-02-25

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