2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid

C16H13N3O3 — CID 166442642

IUPAC2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid
SMILESCc1cc(=O)[nH]c2ccc(Nc3ncccc3C(=O)O)cc12
InChIInChI=1S/C16H13N3O3/c1-9-7-14(20)19-13-5-4-10(8-12(9)13)18-15-11(16(21)22)3-2-6-17-15/h2-8H,1H3,(H,17,18)(H,19,20)(H,21,22)
InChIKeyJKIGPACZMPXCIL-UHFFFAOYSA-N
MW295.30 g/mol
LogP2.67
Rot. Bonds3

About 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid

2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid (PubChem CID 166442642) has the molecular formula C16H13N3O3 and a molecular weight of 295.30 g/mol. Its IUPAC name is 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid
PubChem CID166442642
Molecular FormulaC16H13N3O3
Molecular Weight295.30 g/mol
Exact Mass295.10
IUPAC Name2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid
SMILESCc1cc(=O)[nH]c2ccc(Nc3ncccc3C(=O)O)cc12
InChIInChI=1S/C16H13N3O3/c1-9-7-14(20)19-13-5-4-10(8-12(9)13)18-15-11(16(21)22)3-2-6-17-15/h2-8H,1H3,(H,17,18)(H,19,20)(H,21,22)
InChIKeyJKIGPACZMPXCIL-UHFFFAOYSA-N
XLogP2.67
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.30
LogP ≤ 52.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluoro-3-methylanilino)pyridine-3-carboxylic acid
CID 62812366
2-(4-bromo-3,5-dimethylanilino)pyridine-3-carboxylic acid
CID 107575443
2-(4-acetylanilino)pyridine-3-carboxylic acid
CID 14222049
2-(4-bromo-2,6-dimethylanilino)pyridine-3-carboxylic acid
CID 65499396
2-[[2-(trifluoromethyl)-4-pyridinyl]amino]pyridine-3-carboxylic acid
CID 11716131
2-[3-(hydroxymethyl)morpholin-4-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)pyridine-3-carboxamide
CID 118695126
2-[(2,5-dimethylpyrazol-3-yl)amino]pyridine-3-carboxylic acid
CID 71016995
4-[(3-carbamoyl-2-pyridinyl)amino]-2-methoxybenzoic acid
CID 107208966
2-methyl-4-[(3-methylpyrazin-2-yl)amino]benzoic acid
CID 83065152
3-chloroaniline;2-(3-chloroanilino)pyridine-3-carboxylic acid
CID 158959245
2-(3-naphthalen-2-ylanilino)pyridine-3-carboxylic acid
CID 70027003
3-[(3-ethoxycarbonyl-2-pyridinyl)amino]benzoic acid
CID 43358939

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid?
The IUPAC name of 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid (CID 166442642) is 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid.
What is the SMILES notation for 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid?
The canonical SMILES for 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid is Cc1cc(=O)[nH]c2ccc(Nc3ncccc3C(=O)O)cc12.
What is the InChIKey of 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid?
The InChIKey is JKIGPACZMPXCIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O3/c1-9-7-14(20)19-13-5-4-10(8-12(9)13)18-15-11(16(21)22)3-2-6-17-15/h2-8H,1H3,(H,17,18)(H,19,20)(H,21,22).
What are the key properties of 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid?
2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid has a molecular weight of 295.30 g/mol, XLogP of 2.67, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)amino]pyridine-3-carboxylic acid is sourced from PubChem (CID 166442642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).