2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid

C14H11FN2O3 — CID 63653746

IUPAC2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid
SMILESCc1ccc(C(=O)Nc2ncccc2C(=O)O)cc1F
InChIInChI=1S/C14H11FN2O3/c1-8-4-5-9(7-11(8)15)13(18)17-12-10(14(19)20)3-2-6-16-12/h2-7H,1H3,(H,19,20)(H,16,17,18)
InChIKeyRKEDWLSAZRJWHC-UHFFFAOYSA-N
MW274.25 g/mol
LogP2.48
Rot. Bonds3

About 2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid

2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid (PubChem CID 63653746) has the molecular formula C14H11FN2O3 and a molecular weight of 274.25 g/mol. Its IUPAC name is 2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid
PubChem CID63653746
Molecular FormulaC14H11FN2O3
Molecular Weight274.25 g/mol
Exact Mass274.08
IUPAC Name2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid
SMILESCc1ccc(C(=O)Nc2ncccc2C(=O)O)cc1F
InChIInChI=1S/C14H11FN2O3/c1-8-4-5-9(7-11(8)15)13(18)17-12-10(14(19)20)3-2-6-16-12/h2-7H,1H3,(H,19,20)(H,16,17,18)
InChIKeyRKEDWLSAZRJWHC-UHFFFAOYSA-N
XLogP2.48
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.25
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic 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

2-[(4-bromo-3-fluorobenzoyl)amino]pyridine-3-carboxylic acid
CID 63653566
2-[(3-bromo-4-fluorobenzoyl)amino]pyridine-3-carboxylic acid
CID 107949182
2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid
CID 82881193
2-[(4-chlorobenzoyl)amino]pyridine-3-carboxylic acid
CID 63654258
2-[(2-methyl-5-methylsulfanylbenzoyl)amino]pyridine-3-carboxylic acid
CID 63652866
2-(pyridine-4-carbonylamino)pyridine-3-carboxylic acid
CID 55246558
2-(2,3-dihydro-1H-indene-5-carbonylamino)pyridine-3-carboxylic acid
CID 63652531
2-[(2-fluoro-4-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
CID 107674901
2-[(3-fluoro-4-methylbenzoyl)amino]-5-hydroxybenzoic acid
CID 61405723
2-(4-fluoro-3-methylanilino)pyridine-3-carboxylic acid
CID 62812366
2-[(4,5-dimethylthiophene-2-carbonyl)amino]pyridine-3-carboxylic acid
CID 63653051
2-[(2,4-dichloro-5-fluorobenzoyl)amino]pyridine-3-carboxylic acid
CID 63653408

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid?
The IUPAC name of 2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid (CID 63653746) is 2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid.
What is the SMILES notation for 2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid?
The canonical SMILES for 2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid is Cc1ccc(C(=O)Nc2ncccc2C(=O)O)cc1F.
What is the InChIKey of 2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid?
The InChIKey is RKEDWLSAZRJWHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O3/c1-8-4-5-9(7-11(8)15)13(18)17-12-10(14(19)20)3-2-6-16-12/h2-7H,1H3,(H,19,20)(H,16,17,18).
What are the key properties of 2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid?
2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid has a molecular weight of 274.25 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluoro-4-methylbenzoyl)amino]pyridine-3-carboxylic acid is sourced from PubChem (CID 63653746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).