2-(benzhydrylamino)pyridine-3-carboxylic acid

C19H16N2O2 — CID 82341815

IUPAC2-(benzhydrylamino)pyridine-3-carboxylic acid
SMILESO=C(O)c1cccnc1NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H16N2O2/c22-19(23)16-12-7-13-20-18(16)21-17(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13,17H,(H,20,21)(H,22,23)
InChIKeyAVEUUOPSMYFQDC-UHFFFAOYSA-N
MW304.35 g/mol
LogP3.98
Rot. Bonds5

About 2-(benzhydrylamino)pyridine-3-carboxylic acid

2-(benzhydrylamino)pyridine-3-carboxylic acid (PubChem CID 82341815) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-(benzhydrylamino)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(benzhydrylamino)pyridine-3-carboxylic acid
PubChem CID82341815
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name2-(benzhydrylamino)pyridine-3-carboxylic acid
SMILESO=C(O)c1cccnc1NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H16N2O2/c22-19(23)16-12-7-13-20-18(16)21-17(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13,17H,(H,20,21)(H,22,23)
InChIKeyAVEUUOPSMYFQDC-UHFFFAOYSA-N
XLogP3.98
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(benzhydrylamino)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-[(3-carbamoyl-2-pyridinyl)amino]-2-phenylacetic acid
CID 62109131
2-[1-(3-chlorophenyl)ethylamino]pyridine-3-carboxylic acid
CID 60655016
1-[4-[[(3-methyl-2-pyridinyl)amino]-phenylmethyl]phenyl]ethanone
CID 71528165
2-(pyridine-2-carbonylamino)pyridine-3-carboxylic acid
CID 63654263
2-formamidopyridine-3-carboxylic acid
CID 54137252
N-benzhydryl-3-(trifluoromethyl)pyridin-2-amine
CID 71528051
2-[[(1R)-1-phenylethyl]carbamoyl]pyridine-3-carboxylic acid
CID 63866897
pyridine-2,3-dicarboxylic acid
CID 1066
2-(2-methylbutanoylamino)pyridine-3-carboxylic acid
CID 63654439
2-[(3,4,5-trichloropyridine-2-carbonyl)amino]pyridine-3-carboxylic acid
CID 63653226
2-[(2-chlorophenyl)sulfonylamino]pyridine-3-carboxylic acid
CID 4738922
2-[(2-chloropyridine-3-carbonyl)amino]pyridine-3-carboxylic acid
CID 114036719

Frequently Asked Questions

What is the IUPAC name of 2-(benzhydrylamino)pyridine-3-carboxylic acid?
The IUPAC name of 2-(benzhydrylamino)pyridine-3-carboxylic acid (CID 82341815) is 2-(benzhydrylamino)pyridine-3-carboxylic acid.
What is the SMILES notation for 2-(benzhydrylamino)pyridine-3-carboxylic acid?
The canonical SMILES for 2-(benzhydrylamino)pyridine-3-carboxylic acid is O=C(O)c1cccnc1NC(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(benzhydrylamino)pyridine-3-carboxylic acid?
The InChIKey is AVEUUOPSMYFQDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c22-19(23)16-12-7-13-20-18(16)21-17(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13,17H,(H,20,21)(H,22,23).
What are the key properties of 2-(benzhydrylamino)pyridine-3-carboxylic acid?
2-(benzhydrylamino)pyridine-3-carboxylic acid has a molecular weight of 304.35 g/mol, XLogP of 3.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzhydrylamino)pyridine-3-carboxylic acid is sourced from PubChem (CID 82341815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).