N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide

C23H19N3O3 — CID 53169702

IUPACN-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1nn(-c2ccccc2)c2ccccc2c1=O
InChIInChI=1S/C23H19N3O3/c1-15-12-13-20(29-2)18(14-15)24-23(28)21-22(27)17-10-6-7-11-19(17)26(25-21)16-8-4-3-5-9-16/h3-14H,1-2H3,(H,24,28)
InChIKeyYUGBVYJSWURYSV-UHFFFAOYSA-N
MW385.42 g/mol
LogP3.96
Rot. Bonds4

About N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide

N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide (PubChem CID 53169702) has the molecular formula C23H19N3O3 and a molecular weight of 385.42 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide
PubChem CID53169702
Molecular FormulaC23H19N3O3
Molecular Weight385.42 g/mol
Exact Mass385.14
IUPAC NameN-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1nn(-c2ccccc2)c2ccccc2c1=O
InChIInChI=1S/C23H19N3O3/c1-15-12-13-20(29-2)18(14-15)24-23(28)21-22(27)17-10-6-7-11-19(17)26(25-21)16-8-4-3-5-9-16/h3-14H,1-2H3,(H,24,28)
InChIKeyYUGBVYJSWURYSV-UHFFFAOYSA-N
XLogP3.96
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-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

N-(3-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide
CID 53169689
N-(2-methoxy-5-methylphenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide
CID 4799422
N-(2,5-dimethoxyphenyl)-4-oxo-3-phenylphthalazine-1-carboxamide
CID 2083465
N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide
CID 9208634
N-(2-methoxy-5-methylphenyl)-1,3-dimethylindole-2-carboxamide
CID 113204445
N-(4-chloro-2,5-dimethoxyphenyl)-4-oxo-3-phenylphthalazine-1-carboxamide
CID 26884366
N-(2-methoxy-5-nitrophenyl)-5-methyl-3-(4-methylphenyl)-4-oxopyridazino[4,5-b]indole-1-carboxamide
CID 46253954
N-benzyl-4-oxo-1-phenylcinnoline-3-carboxamide
CID 53169748
N-(2-methoxy-5-methylphenyl)-3,6-dimethyl-1-phenylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 20927945
5-ethyl-N-(2-methoxy-5-methylphenyl)-3-oxo-2-phenylpyrazolo[4,3-c]pyridine-7-carboxamide
CID 18570345
3-bromo-N-(2-methoxy-5-methylphenyl)-1-methylindole-2-carboxamide
CID 55663937
N-(2,3-dimethylphenyl)-1-(4-fluorophenyl)-4-oxocinnoline-3-carboxamide
CID 53169717

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide (CID 53169702) is N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide is COc1ccc(C)cc1NC(=O)c1nn(-c2ccccc2)c2ccccc2c1=O.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide?
The InChIKey is YUGBVYJSWURYSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O3/c1-15-12-13-20(29-2)18(14-15)24-23(28)21-22(27)17-10-6-7-11-19(17)26(25-21)16-8-4-3-5-9-16/h3-14H,1-2H3,(H,24,28).
What are the key properties of N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide?
N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide has a molecular weight of 385.42 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-methylphenyl)-4-oxo-1-phenylcinnoline-3-carboxamide is sourced from PubChem (CID 53169702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).