1-[4-[[(5-cyanopyridin-2-yl)amino]methyl]phenyl]piperidine-3-carboxamide

Systemtic Name: 1-[4-[[(5-cyanopyridin-2-yl)amino]methyl]phenyl]piperidine-3-carboxamide Openeye Name: 1-[4-[[(5-cyano-2-pyridyl)amino]methyl]phenyl]piperidine-3-carboxamide CAS Name: 1-[4-[[(5-cyano-2-pyridinyl)amino]methyl]phenyl]-3-piperidinecarboxamide IUPAC Name: 1-[4-[[(5-cyanopyridin-2-yl)amino]methyl]phenyl]piperidine-3-carboxamide Traditional Name: 1-[4-[[(5-cyano-2-pyridyl)amino]methyl]phenyl]nipecotamide Formula: C19H21N5O MolecularWeight: 335.40294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC=C(C=C2)CNC3=NC=C(C=C3)C#N)C(=O)N

Isomeric SMILES

C1CC(CN(C1)C2=CC=C(C=C2)CNC3=NC=C(C=C3)C#N)C(=O)N

InChI

InChI=1S/C19H21N5O/c20-10-15-5-8-18(23-12-15)22-11-14-3-6-17(7-4-14)24-9-1-2-16(13-24)19(21)25/h3-8,12,16H,1-2,9,11,13H2,(H2,21,25)(H,22,23)