5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid

C15H14N2O3 — CID 106752492

IUPAC5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid
SMILESCc1ccc(NC(=O)c2ccnc(C)c2)c(C(=O)O)c1
InChIInChI=1S/C15H14N2O3/c1-9-3-4-13(12(7-9)15(19)20)17-14(18)11-5-6-16-10(2)8-11/h3-8H,1-2H3,(H,17,18)(H,19,20)
InChIKeyJTYFWWFOUBICHA-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.65
Rot. Bonds3

About 5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid

5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid (PubChem CID 106752492) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is 5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid.

Molecular Properties

Compound Name5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid
PubChem CID106752492
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid
SMILESCc1ccc(NC(=O)c2ccnc(C)c2)c(C(=O)O)c1
InChIInChI=1S/C15H14N2O3/c1-9-3-4-13(12(7-9)15(19)20)17-14(18)11-5-6-16-10(2)8-11/h3-8H,1-2H3,(H,17,18)(H,19,20)
InChIKeyJTYFWWFOUBICHA-UHFFFAOYSA-N
XLogP2.65
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid 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

5-methyl-2-(pyridine-4-carbonylamino)benzoic acid
CID 24701556
5-methyl-2-[(6-methylpyridine-3-carbonyl)amino]benzoic acid
CID 24702059
2-[(3,5-dihydroxybenzoyl)amino]-5-methylbenzoic acid
CID 107702371
2-[(3-hydroxybenzoyl)amino]-5-methylbenzoic acid
CID 24700759
2-[(3-amino-4-bromobenzoyl)amino]-5-methylbenzoic acid
CID 107812978
2-[(5-aminopyridine-3-carbonyl)amino]-5-methylbenzoic acid
CID 110488447
2-[(2-fluoro-5-methylbenzoyl)amino]-5-methylbenzoic acid
CID 62515827
2-[(3-acetyloxybenzoyl)amino]-5-methylbenzoic acid
CID 142866220
5-methyl-2-[(2-methylbenzoyl)amino]benzoic acid
CID 21232994
N-(2-bromo-3-methylphenyl)-2-methylpyridine-4-carboxamide
CID 106753102
N,2-dimethylpyridine-4-carboxamide;ethane
CID 143416894
2-[[3-(cyclopropanecarbonylamino)benzoyl]amino]-5-methylbenzoic acid
CID 17172311

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid?
The IUPAC name of 5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid (CID 106752492) is 5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid.
What is the SMILES notation for 5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid?
The canonical SMILES for 5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid is Cc1ccc(NC(=O)c2ccnc(C)c2)c(C(=O)O)c1.
What is the InChIKey of 5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid?
The InChIKey is JTYFWWFOUBICHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-9-3-4-13(12(7-9)15(19)20)17-14(18)11-5-6-16-10(2)8-11/h3-8H,1-2H3,(H,17,18)(H,19,20).
What are the key properties of 5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid?
5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid has a molecular weight of 270.29 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[(2-methylpyridine-4-carbonyl)amino]benzoic acid is sourced from PubChem (CID 106752492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).