6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid

C8H7N3O2 — CID 130958723

IUPAC6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid
SMILESCc1cnc2nc(C(=O)O)[nH]c2c1
InChIInChI=1S/C8H7N3O2/c1-4-2-5-6(9-3-4)11-7(10-5)8(12)13/h2-3H,1H3,(H,12,13)(H,9,10,11)
InChIKeyBCOYKFDKZRKDSR-UHFFFAOYSA-N
MW177.16 g/mol
LogP0.96
Rot. Bonds1

About 6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid

6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid (PubChem CID 130958723) has the molecular formula C8H7N3O2 and a molecular weight of 177.16 g/mol. Its IUPAC name is 6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid
PubChem CID130958723
Molecular FormulaC8H7N3O2
Molecular Weight177.16 g/mol
Exact Mass177.05
IUPAC Name6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid
SMILESCc1cnc2nc(C(=O)O)[nH]c2c1
InChIInChI=1S/C8H7N3O2/c1-4-2-5-6(9-3-4)11-7(10-5)8(12)13/h2-3H,1H3,(H,12,13)(H,9,10,11)
InChIKeyBCOYKFDKZRKDSR-UHFFFAOYSA-N
XLogP0.96
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.16
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine
CID 122362438
2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclopropane-1-carboxylic acid
CID 79795345
6-methyl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
CID 79015215
6-methyl-2-phenyl-1H-imidazo[4,5-b]pyridine
CID 79015212
4-bromo-6-methyl-1H-benzimidazole-2-carboxylic acid
CID 84635509
6-methyl-2-(trichloromethyl)-1H-imidazo[4,5-b]pyridine
CID 82142248
6-methyl-2-pyridin-3-yl-1H-imidazo[4,5-b]pyridine
CID 79015085
2-(3-methylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82821422
2,2-dimethyl-1-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine
CID 79796039
6-methyl-2-(5-methylfuran-3-yl)-1H-imidazo[4,5-b]pyridine
CID 114821625
5-methyl-1H-benzimidazole-2,4-dicarboxylic acid
CID 19759653
2-amino-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82820572

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid?
The IUPAC name of 6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid (CID 130958723) is 6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid?
The canonical SMILES for 6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid is Cc1cnc2nc(C(=O)O)[nH]c2c1.
What is the InChIKey of 6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid?
The InChIKey is BCOYKFDKZRKDSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O2/c1-4-2-5-6(9-3-4)11-7(10-5)8(12)13/h2-3H,1H3,(H,12,13)(H,9,10,11).
What are the key properties of 6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid?
6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid has a molecular weight of 177.16 g/mol, XLogP of 0.96, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1H-imidazo[4,5-b]pyridine-2-carboxylic acid is sourced from PubChem (CID 130958723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).