3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid

C20H15N3O5 — CID 154791964

IUPAC3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid
SMILESO=C(O)c1ccc(NC(=O)c2ccccn2)c(NC(=O)c2ccccc2O)c1
InChIInChI=1S/C20H15N3O5/c24-17-7-2-1-5-13(17)18(25)23-16-11-12(20(27)28)8-9-14(16)22-19(26)15-6-3-4-10-21-15/h1-11,24H,(H,22,26)(H,23,25)(H,27,28)
InChIKeyPHMMNCJHSWJDAW-UHFFFAOYSA-N
MW377.36 g/mol
LogP2.99
Rot. Bonds5

About 3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid

3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid (PubChem CID 154791964) has the molecular formula C20H15N3O5 and a molecular weight of 377.36 g/mol. Its IUPAC name is 3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid.

Molecular Properties

Compound Name3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid
PubChem CID154791964
Molecular FormulaC20H15N3O5
Molecular Weight377.36 g/mol
Exact Mass377.10
IUPAC Name3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid
SMILESO=C(O)c1ccc(NC(=O)c2ccccn2)c(NC(=O)c2ccccc2O)c1
InChIInChI=1S/C20H15N3O5/c24-17-7-2-1-5-13(17)18(25)23-16-11-12(20(27)28)8-9-14(16)22-19(26)15-6-3-4-10-21-15/h1-11,24H,(H,22,26)(H,23,25)(H,27,28)
InChIKeyPHMMNCJHSWJDAW-UHFFFAOYSA-N
XLogP2.99
TPSA128.62 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.36
LogP ≤ 52.99
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze 3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)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

4-methyl-3-(pyridine-2-carbonylamino)benzoic acid
CID 16771811
3-[(2-chloropyridine-3-carbonyl)amino]-4-hydroxybenzoic acid
CID 9182555
3-fluoro-4-[(2-hydroxybenzoyl)amino]benzoic acid
CID 63190129
3-amino-4-[(2-hydroxybenzoyl)amino]benzoic acid
CID 63117270
N-[2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide;ruthenium(2+);dichloride
CID 46845295
N-[4-methyl-2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide
CID 4867706
4-(pyridine-2-carbonylamino)benzoic acid
CID 16770258
N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide
CID 55834647
3-[(4-chloropyridine-2-carbonyl)amino]-4-hydroxybenzoic acid
CID 107264628
6-[(2-hydroxybenzoyl)amino]pyridine-3-carboxylic acid
CID 61317349
3-[(2-benzoylbenzoyl)amino]-4-hydroxybenzoic acid
CID 108753900
2-(pyridine-2-carbonylamino)pyridine-3-carboxylic acid
CID 63654263

Frequently Asked Questions

What is the IUPAC name of 3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid?
The IUPAC name of 3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid (CID 154791964) is 3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid.
What is the SMILES notation for 3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid?
The canonical SMILES for 3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid is O=C(O)c1ccc(NC(=O)c2ccccn2)c(NC(=O)c2ccccc2O)c1.
What is the InChIKey of 3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid?
The InChIKey is PHMMNCJHSWJDAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O5/c24-17-7-2-1-5-13(17)18(25)23-16-11-12(20(27)28)8-9-14(16)22-19(26)15-6-3-4-10-21-15/h1-11,24H,(H,22,26)(H,23,25)(H,27,28).
What are the key properties of 3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid?
3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid has a molecular weight of 377.36 g/mol, XLogP of 2.99, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-hydroxybenzoyl)amino]-4-(pyridine-2-carbonylamino)benzoic acid is sourced from PubChem (CID 154791964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).