2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid

C13H10N4O2S — CID 103385259

IUPAC2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid
SMILESCn1cnc2c(Sc3cc(C(=O)O)ccn3)nccc21
InChIInChI=1S/C13H10N4O2S/c1-17-7-16-11-9(17)3-5-15-12(11)20-10-6-8(13(18)19)2-4-14-10/h2-7H,1H3,(H,18,19)
InChIKeyGCKKNZGBYKOXHR-UHFFFAOYSA-N
MW286.32 g/mol
LogP2.21
Rot. Bonds3

About 2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid

2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid (PubChem CID 103385259) has the molecular formula C13H10N4O2S and a molecular weight of 286.32 g/mol. Its IUPAC name is 2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid
PubChem CID103385259
Molecular FormulaC13H10N4O2S
Molecular Weight286.32 g/mol
Exact Mass286.05
IUPAC Name2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid
SMILESCn1cnc2c(Sc3cc(C(=O)O)ccn3)nccc21
InChIInChI=1S/C13H10N4O2S/c1-17-7-16-11-9(17)3-5-15-12(11)20-10-6-8(13(18)19)2-4-14-10/h2-7H,1H3,(H,18,19)
InChIKeyGCKKNZGBYKOXHR-UHFFFAOYSA-N
XLogP2.21
TPSA80.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.32
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-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-[(2,4-dimethyl-3,5-dioxo-1,2,4-triazin-6-yl)sulfanyl]pyridine-4-carboxylic acid
CID 61301283
2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]pyridine-4-carboxylic acid
CID 60726288
2-(3-cyanopyrazin-2-yl)sulfanylpyridine-4-carboxylic acid
CID 55104969
2-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]pyridine-4-carboxylic acid
CID 103385145
2-(6-methylsulfanylpyrimidin-4-yl)sulfanylpyridine-4-carboxylic acid
CID 106972467
[4-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylphenyl]methanol
CID 103385923
2-[(2-methyltetrazol-5-yl)methylsulfanyl]pyridine-4-carboxylic acid
CID 107041022
2-(2-methylfuran-3-yl)sulfanylpyridine-4-carboxylic acid
CID 107779261
2-(1-methylpiperidin-4-yl)sulfanylpyridine-4-carboxylic acid
CID 138591006
2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pyridine-4-carboxylic acid
CID 60726439
2-(trifluoromethylsulfanyl)pyridine-4-carboxylic acid
CID 61301083
2-thieno[2,3-d]pyrimidin-4-ylsulfanylpyridine-4-carboxylic acid
CID 60726195

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid?
The IUPAC name of 2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid (CID 103385259) is 2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid.
What is the SMILES notation for 2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid?
The canonical SMILES for 2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid is Cn1cnc2c(Sc3cc(C(=O)O)ccn3)nccc21.
What is the InChIKey of 2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid?
The InChIKey is GCKKNZGBYKOXHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O2S/c1-17-7-16-11-9(17)3-5-15-12(11)20-10-6-8(13(18)19)2-4-14-10/h2-7H,1H3,(H,18,19).
What are the key properties of 2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid?
2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid has a molecular weight of 286.32 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylimidazo[4,5-c]pyridin-4-yl)sulfanylpyridine-4-carboxylic acid is sourced from PubChem (CID 103385259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).