Molecule ID: 994729

IUPAC Name: 2-(3-propan-2-yloxyphenyl)-N-pyridin-4-ylquinoline-4-carboxamide

Description: The molecule is a member of the class of quinolines that is the amide obtained from formal condensation of the carboxy group of 2-(2-isopropyloxyphenyl)quinoline-4-carboxylic acid with the amino group of 4-aminopyridine. It is a member of quinolines, an aromatic amide, a monocarboxylic acid amide, an aromatic ether and a member of pyridines.

SMILES: CC(C)Oc1cccc(-c2cc(C(=O)N=c3cc[nH]cc3)c3ccccc3n2)c1

SELFIES: [C][C][Branch1][C][C][O][C][=C][C][=C][C][Branch2][Ring1][#C][C][=C][C][Branch1][=C][C][=Branch1][C][=O][N][=C][C][=C][NH1][C][=C][Ring1][=Branch1][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring2][Ring1][Ring1][=C][Ring2][Ring1][=Branch2]

InChI: InChI=1S/C24H21N3O2/c1-16(2)29-19-7-5-6-17(14-19)23-15-21(20-8-3-4-9-22(20)27-23)24(28)26-18-10-12-25-13-11-18/h3-16H,1-2H3,(H,25,26,28)

Molecular Properties:
- Polar Surface Area: 64.099 Ų
- LogP: 4.4