N-[4-[(1R,3S,5S)-3-azanyl-5-methyl-cyclohexyl]pyridin-3-yl]-6-(2-fluoranyl-5-methyl-phenyl)pyridine-2-carboxamide

Systemtic Name: N-[4-[(1R,3S,5S)-3-azanyl-5-methyl-cyclohexyl]pyridin-3-yl]-6-(2-fluoranyl-5-methyl-phenyl)pyridine-2-carboxamide Openeye Name: N-[4-[(1R,3S,5S)-3-amino-5-methyl-cyclohexyl]-3-pyridyl]-6-(2-fluoro-5-methyl-phenyl)pyridine-2-carboxamide CAS Name: N-[4-[(1R,3S,5S)-3-amino-5-methylcyclohexyl]-3-pyridinyl]-6-(2-fluoro-5-methylphenyl)-2-pyridinecarboxamide IUPAC Name: N-[4-[(1R,3S,5S)-3-amino-5-methylcyclohexyl]pyridin-3-yl]-6-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide Traditional Name: N-[4-[(1R,3S,5S)-3-amino-5-methyl-cyclohexyl]-3-pyridyl]-6-(2-fluoro-5-methyl-phenyl)picolinamide Formula: C25H27FN4O MolecularWeight: 418.506483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)N)C2=C(C=NC=C2)NC(=O)C3=CC=CC(=N3)C4=C(C=CC(=C4)C)F

Isomeric SMILES

C[C@H]1C[C@H](C[C@H](C1)N)C2=C(C=NC=C2)NC(=O)C3=CC=CC(=N3)C4=C(C=CC(=C4)C)F

InChI

InChI=1S/C25H27FN4O/c1-15-6-7-21(26)20(12-15)22-4-3-5-23(29-22)25(31)30-24-14-28-9-8-19(24)17-10-16(2)11-18(27)13-17/h3-9,12,14,16-18H,10-11,13,27H2,1-2H3,(H,30,31)/t16-,17+,18-/m0/s1