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3B0

Summary
Name:5-(trifluoromethyl)pyridin-2-amine
Formula:C6 H5 F3 N2
Formal charge:0
Formula weight:162.113 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.015-(trifluoromethyl)pyridin-2-amine
OpenEye OEToolkits1.9.25-(trifluoromethyl)pyridin-2-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01FC(F)(F)c1cnc(N)cc1
InChIInChI1.03InChI=1S/C6H5F3N2/c7-6(8,9)4-1-2-5(10)11-3-4/h1-3H,(H2,10,11)
InChIKeyInChI1.03RSGVKIIEIXOMPY-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Nc1ccc(cn1)C(F)(F)F
SMILESCACTVS3.385Nc1ccc(cn1)C(F)(F)F
SMILES_CANONICALOpenEye OEToolkits1.9.2c1cc(ncc1C(F)(F)F)N
SMILESOpenEye OEToolkits1.9.2c1cc(ncc1C(F)(F)F)N

222926

PDB entries from 2024-07-24

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