3-methylimidazo[4,5-c]pyridine-4-carboxylic acid

C8H7N3O2 — CID 84655857

IUPAC3-methylimidazo[4,5-c]pyridine-4-carboxylic acid
SMILESCn1cnc2ccnc(C(=O)O)c21
InChIInChI=1S/C8H7N3O2/c1-11-4-10-5-2-3-9-6(7(5)11)8(12)13/h2-4H,1H3,(H,12,13)
InChIKeyGDBYRGXVDLRJPK-UHFFFAOYSA-N
MW177.16 g/mol
LogP0.67
Rot. Bonds1

About 3-methylimidazo[4,5-c]pyridine-4-carboxylic acid

3-methylimidazo[4,5-c]pyridine-4-carboxylic acid (PubChem CID 84655857) has the molecular formula C8H7N3O2 and a molecular weight of 177.16 g/mol. Its IUPAC name is 3-methylimidazo[4,5-c]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name3-methylimidazo[4,5-c]pyridine-4-carboxylic acid
PubChem CID84655857
Molecular FormulaC8H7N3O2
Molecular Weight177.16 g/mol
Exact Mass177.05
IUPAC Name3-methylimidazo[4,5-c]pyridine-4-carboxylic acid
SMILESCn1cnc2ccnc(C(=O)O)c21
InChIInChI=1S/C8H7N3O2/c1-11-4-10-5-2-3-9-6(7(5)11)8(12)13/h2-4H,1H3,(H,12,13)
InChIKeyGDBYRGXVDLRJPK-UHFFFAOYSA-N
XLogP0.67
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.16
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methylpyrrolo[3,2-c]pyridine-4-carboxylic acid
CID 137347030
3-methyl-4-nitrobenzimidazole-5-carboxylic acid
CID 130407383
3-methyl-4-piperazin-1-ylimidazo[4,5-c]pyridine
CID 84683022
3-methylbenzimidazol-4-ol
CID 3771453
7-bromo-1-methylbenzimidazole-5-carboxylic acid
CID 75487801
3-methyl-6-(4-phenylphenyl)benzimidazole-4-carboxylic acid
CID 157085723
1-methylimidazo[4,5-c]pyridine-6-carboxylic acid;dihydrochloride
CID 138040516
1-(1-methylpyrrolo[2,3-c]pyridin-7-yl)ethanone
CID 154728478
1,6,7-trimethylbenzimidazole
CID 83449271
3,4-dichloropyridine-2-carboxylic acid;hydrate
CID 141213155
2-(3-methylbenzimidazol-5-yl)oxyacetic acid
CID 84673953
palladium;pyrazine-2,3-dicarboxylic acid
CID 174785540

Frequently Asked Questions

What is the IUPAC name of 3-methylimidazo[4,5-c]pyridine-4-carboxylic acid?
The IUPAC name of 3-methylimidazo[4,5-c]pyridine-4-carboxylic acid (CID 84655857) is 3-methylimidazo[4,5-c]pyridine-4-carboxylic acid.
What is the SMILES notation for 3-methylimidazo[4,5-c]pyridine-4-carboxylic acid?
The canonical SMILES for 3-methylimidazo[4,5-c]pyridine-4-carboxylic acid is Cn1cnc2ccnc(C(=O)O)c21.
What is the InChIKey of 3-methylimidazo[4,5-c]pyridine-4-carboxylic acid?
The InChIKey is GDBYRGXVDLRJPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O2/c1-11-4-10-5-2-3-9-6(7(5)11)8(12)13/h2-4H,1H3,(H,12,13).
What are the key properties of 3-methylimidazo[4,5-c]pyridine-4-carboxylic acid?
3-methylimidazo[4,5-c]pyridine-4-carboxylic acid has a molecular weight of 177.16 g/mol, XLogP of 0.67, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylimidazo[4,5-c]pyridine-4-carboxylic acid is sourced from PubChem (CID 84655857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).