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

C13H13N3O2 — CID 69237499

IUPAC6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid
SMILESCc1cncc(Nc2ccc(C)nc2C(=O)O)c1
InChIInChI=1S/C13H13N3O2/c1-8-5-10(7-14-6-8)16-11-4-3-9(2)15-12(11)13(17)18/h3-7,16H,1-2H3,(H,17,18)
InChIKeyGNHZGAUDEKEFCR-UHFFFAOYSA-N
MW243.27 g/mol
LogP2.54
Rot. Bonds3

About 6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid

6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid (PubChem CID 69237499) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is 6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid
PubChem CID69237499
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC Name6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid
SMILESCc1cncc(Nc2ccc(C)nc2C(=O)O)c1
InChIInChI=1S/C13H13N3O2/c1-8-5-10(7-14-6-8)16-11-4-3-9(2)15-12(11)13(17)18/h3-7,16H,1-2H3,(H,17,18)
InChIKeyGNHZGAUDEKEFCR-UHFFFAOYSA-N
XLogP2.54
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-methyl-3-[(5-methyl-3-pyridinyl)amino]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

4-[(5-methyl-3-pyridinyl)amino]quinoline-2-carboxylic acid
CID 107585776
3-(3-cyanoanilino)-6-methylpyridine-2-carboxylic acid
CID 69235478
5-amino-2-[(5-methyl-3-pyridinyl)amino]benzamide
CID 107586461
methyl 3-amino-4-[(5-methyl-3-pyridinyl)amino]benzoate
CID 107586479
4-methyl-3-[(5-methyl-3-pyridinyl)amino]-5-nitrobenzoic acid
CID 107585738
3,6-dimethylpyridine-2-carboxylic acid
CID 13209567
1-(5-methyl-3-pyridinyl)-3-phenylurea
CID 110748489
3-bromo-N-(5-methyl-3-pyridinyl)pyridin-4-amine
CID 107586507
3-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-6-methylpyridine-2-carboxylic acid
CID 69238429
6-methyl-3-(prop-2-enoxycarbonylamino)pyridine-2-carboxylic acid
CID 68819422
1-[3-methyl-5-[(5-methyl-3-pyridinyl)amino]-1,2-thiazol-4-yl]ethanone
CID 107587099
6-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-(pyrimidin-5-ylamino)pyridine-2-carboxylic acid
CID 69235514

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid?
The IUPAC name of 6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid (CID 69237499) is 6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid?
The canonical SMILES for 6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid is Cc1cncc(Nc2ccc(C)nc2C(=O)O)c1.
What is the InChIKey of 6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid?
The InChIKey is GNHZGAUDEKEFCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2/c1-8-5-10(7-14-6-8)16-11-4-3-9(2)15-12(11)13(17)18/h3-7,16H,1-2H3,(H,17,18).
What are the key properties of 6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid?
6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid has a molecular weight of 243.27 g/mol, XLogP of 2.54, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-[(5-methyl-3-pyridinyl)amino]pyridine-2-carboxylic acid is sourced from PubChem (CID 69237499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).