2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid

C13H8ClN3O2 — CID 112582623

IUPAC2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
SMILESO=C(O)c1ccnc2nc(-c3ccccc3Cl)[nH]c12
InChIInChI=1S/C13H8ClN3O2/c14-9-4-2-1-3-7(9)11-16-10-8(13(18)19)5-6-15-12(10)17-11/h1-6H,(H,18,19)(H,15,16,17)
InChIKeyCUUBJQUYOKNEPV-UHFFFAOYSA-N
MW273.68 g/mol
LogP2.98
Rot. Bonds2

About 2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid

2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid (PubChem CID 112582623) has the molecular formula C13H8ClN3O2 and a molecular weight of 273.68 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid.

Molecular Properties

Compound Name2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
PubChem CID112582623
Molecular FormulaC13H8ClN3O2
Molecular Weight273.68 g/mol
Exact Mass273.03
IUPAC Name2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
SMILESO=C(O)c1ccnc2nc(-c3ccccc3Cl)[nH]c12
InChIInChI=1S/C13H8ClN3O2/c14-9-4-2-1-3-7(9)11-16-10-8(13(18)19)5-6-15-12(10)17-11/h1-6H,(H,18,19)(H,15,16,17)
InChIKeyCUUBJQUYOKNEPV-UHFFFAOYSA-N
XLogP2.98
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.68
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-chloro-4-pyridinyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 112582695
2-(2,3-difluorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 115938268
2-(2,5-dichlorothiophen-3-yl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 114021462
2-(5-chloro-2-methylphenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 115938354
2-[2-fluoro-4-(2-fluorophenyl)phenyl]-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 118484953
2-(4-bromothiophen-3-yl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 167937720
2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 68935802
2-(6-methyl-2-pyridinyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 112582603
2-(2-bromo-5-fluorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 115938362
2-(2H-triazol-4-yl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 136923432
2-(6-oxo-1H-pyridazin-3-yl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid
CID 136966691
7-chloro-2-(2-methylphenyl)-1H-imidazo[4,5-b]pyridine
CID 84704131

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid?
The IUPAC name of 2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid (CID 112582623) is 2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid.
What is the SMILES notation for 2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid?
The canonical SMILES for 2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid is O=C(O)c1ccnc2nc(-c3ccccc3Cl)[nH]c12.
What is the InChIKey of 2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid?
The InChIKey is CUUBJQUYOKNEPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClN3O2/c14-9-4-2-1-3-7(9)11-16-10-8(13(18)19)5-6-15-12(10)17-11/h1-6H,(H,18,19)(H,15,16,17).
What are the key properties of 2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid?
2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid has a molecular weight of 273.68 g/mol, XLogP of 2.98, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-1H-imidazo[4,5-b]pyridine-7-carboxylic acid is sourced from PubChem (CID 112582623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).