Molecule ID: 10364826

IUPAC Name: N-[4-[2-(4-fluoroanilino)pyridin-4-yl]pyridin-2-yl]-4-methoxycyclohexane-1-carboxamide

Description: The molecule is a member of the class of bipyridines that is 4,4'-bipyridine substituted at positions 2 and 2' by 4-fluoroaminophenyl and 4-methoxycyclohexanecarboxamido groups respectively. It is a member of bipyridines, a monocarboxylic acid amide, an ether, an organofluorine compound, an aromatic amine and a secondary amino compound.

SMILES: COC1CCC(C(O)=Nc2cc(-c3ccnc(Nc4ccc(F)cc4)c3)ccn2)CC1

SELFIES: [C][O][C][C][C][C][Branch2][Ring2][Branch2][C][Branch1][C][O][=N][C][=C][C][Branch2][Ring1][#Branch1][C][=C][C][=N][C][Branch1][=N][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][Ring1][=C][=C][C][=N][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][=N]

InChI: InChI=1S/C24H25FN4O2/c1-31-21-8-2-16(3-9-21)24(30)29-23-15-18(11-13-27-23)17-10-12-26-22(14-17)28-20-6-4-19(25)5-7-20/h4-7,10-16,21H,2-3,8-9H2,1H3,(H,26,28)(H,27,29,30)

Molecular Properties:
- Polar Surface Area: 76.1 Ų
- LogP: 4.0