5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid

C14H12N2O4 — CID 81099820

IUPAC5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid
SMILESO=C(NCc1ccc(C(=O)O)nc1)c1cccc(O)c1
InChIInChI=1S/C14H12N2O4/c17-11-3-1-2-10(6-11)13(18)16-8-9-4-5-12(14(19)20)15-7-9/h1-7,17H,8H2,(H,16,18)(H,19,20)
InChIKeyBBPBKYDNWJMATC-UHFFFAOYSA-N
MW272.26 g/mol
LogP1.42
Rot. Bonds4

About 5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid

5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid (PubChem CID 81099820) has the molecular formula C14H12N2O4 and a molecular weight of 272.26 g/mol. Its IUPAC name is 5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid
PubChem CID81099820
Molecular FormulaC14H12N2O4
Molecular Weight272.26 g/mol
Exact Mass272.08
IUPAC Name5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid
SMILESO=C(NCc1ccc(C(=O)O)nc1)c1cccc(O)c1
InChIInChI=1S/C14H12N2O4/c17-11-3-1-2-10(6-11)13(18)16-8-9-4-5-12(14(19)20)15-7-9/h1-7,17H,8H2,(H,16,18)(H,19,20)
InChIKeyBBPBKYDNWJMATC-UHFFFAOYSA-N
XLogP1.42
TPSA99.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 51.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-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

5-[[(4-amino-3-bromobenzoyl)amino]methyl]pyridine-2-carboxylic acid
CID 81090066
3-hydroxy-N-(quinolin-3-ylmethyl)benzamide
CID 110472397
5-[[(2-fluoro-6-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid
CID 107013740
2-[[(3-hydroxybenzoyl)amino]methyl]-1,3-thiazole-4-carboxylic acid
CID 66381423
5-[[(6-methylpyridine-2-carbonyl)amino]methyl]pyridine-2-carboxylic acid
CID 81099042
5-[[(2-hydroxy-5-iodobenzoyl)amino]methyl]pyridine-2-carboxylic acid
CID 107731417
5-[[(5-methylpyrazine-2-carbonyl)amino]methyl]pyridine-2-carboxylic acid
CID 81100153
5-[[(3-chloro-2-fluorobenzoyl)amino]methyl]pyridine-2-carboxylic acid
CID 81266256
5-[[(2-chloro-6-fluorobenzoyl)amino]methyl]pyridine-2-carboxylic acid
CID 81091399
5-[[(3-chloro-2-methylbenzoyl)amino]methyl]pyridine-2-carboxylic acid
CID 107096018
5-[[3-(benzylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylic acid
CID 57079415
5-[[(5-chlorofuran-2-carbonyl)amino]methyl]pyridine-2-carboxylic acid
CID 81098591

Frequently Asked Questions

What is the IUPAC name of 5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid?
The IUPAC name of 5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid (CID 81099820) is 5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid?
The canonical SMILES for 5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid is O=C(NCc1ccc(C(=O)O)nc1)c1cccc(O)c1.
What is the InChIKey of 5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid?
The InChIKey is BBPBKYDNWJMATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O4/c17-11-3-1-2-10(6-11)13(18)16-8-9-4-5-12(14(19)20)15-7-9/h1-7,17H,8H2,(H,16,18)(H,19,20).
What are the key properties of 5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid?
5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid has a molecular weight of 272.26 g/mol, XLogP of 1.42, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 81099820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).