3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide

C25H17ClN4O2 — CID 137438905

IUPAC3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide
SMILESCNC(=O)c1c(-c2cc(Cl)c3ncccc3c2)c(-c2ccccc2)nc2[nH]ccc(=O)c12
InChIInChI=1S/C25H17ClN4O2/c1-27-25(32)21-19(16-12-15-8-5-10-28-22(15)17(26)13-16)23(14-6-3-2-4-7-14)30-24-20(21)18(31)9-11-29-24/h2-13H,1H3,(H,27,32)(H,29,30,31)
InChIKeyWGXICQXWBJQWKX-UHFFFAOYSA-N
MW440.89 g/mol
LogP4.82
Rot. Bonds3

About 3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide

3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide (PubChem CID 137438905) has the molecular formula C25H17ClN4O2 and a molecular weight of 440.89 g/mol. Its IUPAC name is 3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide.

Molecular Properties

Compound Name3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide
PubChem CID137438905
Molecular FormulaC25H17ClN4O2
Molecular Weight440.89 g/mol
Exact Mass440.10
IUPAC Name3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide
SMILESCNC(=O)c1c(-c2cc(Cl)c3ncccc3c2)c(-c2ccccc2)nc2[nH]ccc(=O)c12
InChIInChI=1S/C25H17ClN4O2/c1-27-25(32)21-19(16-12-15-8-5-10-28-22(15)17(26)13-16)23(14-6-3-2-4-7-14)30-24-20(21)18(31)9-11-29-24/h2-13H,1H3,(H,27,32)(H,29,30,31)
InChIKeyWGXICQXWBJQWKX-UHFFFAOYSA-N
XLogP4.82
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.89
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(8-chloroquinolin-6-yl)-5-(1-methylazetidin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one
CID 137438550
6-(8-chloroquinolin-6-yl)-7-pyridin-3-yl-1H-1,8-naphthyridin-4-one
CID 137438341
6-(8-chloroquinolin-6-yl)-5-(methylaminomethyl)-7-phenyl-1H-1,8-naphthyridin-2-one
CID 137438503
8-chloro-2-(8-chloroquinolin-6-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-6-one
CID 154656598
6-(8-chloroquinolin-6-yl)-5-(methylsulfanylmethyl)-7-phenyl-1H-1,8-naphthyridin-2-one
CID 137438467
7-bromo-2-(8-chloroquinolin-6-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154656457
7-phenyl-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one
CID 137423248
2-(8-chloroquinolin-6-yl)-6-ethenyl-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154657636
2-(8-chloroquinolin-6-yl)-8-ethyl-3-phenyl-5H-pyrido[2,3-b]pyrazin-6-one
CID 154656495
6-(1,8-naphthyridin-3-yl)-7-phenyl-1H-1,8-naphthyridin-4-one
CID 137423219
6-(8-chloroquinolin-6-yl)-7-phenyl-2,3-didehydro-1H-1,8-naphthyridin-4-one
CID 155170939
6-(8-chloroquinolin-6-yl)-5-(cyclopropylmethyl)-7-phenyl-1H-1,8-naphthyridin-2-one
CID 137438658

Frequently Asked Questions

What is the IUPAC name of 3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide?
The IUPAC name of 3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide (CID 137438905) is 3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide.
What is the SMILES notation for 3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide?
The canonical SMILES for 3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide is CNC(=O)c1c(-c2cc(Cl)c3ncccc3c2)c(-c2ccccc2)nc2[nH]ccc(=O)c12.
What is the InChIKey of 3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide?
The InChIKey is WGXICQXWBJQWKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17ClN4O2/c1-27-25(32)21-19(16-12-15-8-5-10-28-22(15)17(26)13-16)23(14-6-3-2-4-7-14)30-24-20(21)18(31)9-11-29-24/h2-13H,1H3,(H,27,32)(H,29,30,31).
What are the key properties of 3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide?
3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide has a molecular weight of 440.89 g/mol, XLogP of 4.82, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-chloroquinolin-6-yl)-N-methyl-5-oxo-2-phenyl-8H-1,8-naphthyridine-4-carboxamide is sourced from PubChem (CID 137438905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).