Molecule ID: 53484025

IUPAC Name: N,4-dimethoxy-6-pyridin-2-ylpyridine-2-carboxamide

Description: The molecule is a pyridine alkaloid that is 2,2'-bipyridine-6-carboxamide substituted by methoxy groups at position 4 and carbamoyl nitrogen respectively. Isolated from the marine-derived actinomycete Actinoalloteichus cyanogriseus, it exhibits antineoplastic activity. It has a role as an antineoplastic agent, a bacterial metabolite and a marine metabolite. It is an aromatic ether, a pyridinecarboxamide, a member of bipyridines and a pyridine alkaloid. It derives from a hydride of a 2,2'-bipyridine.

SMILES: CON=C(O)c1cc(OC)cc(-c2ccccn2)n1

SELFIES: [C][O][N][=C][Branch1][C][O][C][=C][C][Branch1][Ring1][O][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][=N][Ring1][=C]

InChI: InChI=1S/C13H13N3O3/c1-18-9-7-11(10-5-3-4-6-14-10)15-12(8-9)13(17)16-19-2/h3-8H,1-2H3,(H,16,17)

Molecular Properties:
- Polar Surface Area: 73.3 Ų
- LogP: 1.1