2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid

C13H7F2N3O2 — CID 82821137

IUPAC2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
SMILESO=C(O)c1cnc2nc(-c3cc(F)cc(F)c3)[nH]c2c1
InChIInChI=1S/C13H7F2N3O2/c14-8-1-6(2-9(15)4-8)11-17-10-3-7(13(19)20)5-16-12(10)18-11/h1-5H,(H,19,20)(H,16,17,18)
InChIKeyORQSGZALMKEDBM-UHFFFAOYSA-N
MW275.21 g/mol
LogP2.60
Rot. Bonds2

About 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid

2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid (PubChem CID 82821137) has the molecular formula C13H7F2N3O2 and a molecular weight of 275.21 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
PubChem CID82821137
Molecular FormulaC13H7F2N3O2
Molecular Weight275.21 g/mol
Exact Mass275.05
IUPAC Name2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
SMILESO=C(O)c1cnc2nc(-c3cc(F)cc(F)c3)[nH]c2c1
InChIInChI=1S/C13H7F2N3O2/c14-8-1-6(2-9(15)4-8)11-17-10-3-7(13(19)20)5-16-12(10)18-11/h1-5H,(H,19,20)(H,16,17,18)
InChIKeyORQSGZALMKEDBM-UHFFFAOYSA-N
XLogP2.60
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.21
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82821422
2-thiophen-3-yl-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82820668
2-(3-fluoro-4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82796325
2-(4-chloro-2,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82796397
2-(3-chloro-2-fluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82820856
2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82821325
2-(3-bromo-4-chlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 107989451
2-(4-ethoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82796070
2-pyridin-2-yl-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82821320
2-amino-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82820572
2-(2-methylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82821514
2-(3-methoxy-4-methylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82795992

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid?
The IUPAC name of 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid (CID 82821137) is 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid.
What is the SMILES notation for 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid?
The canonical SMILES for 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid is O=C(O)c1cnc2nc(-c3cc(F)cc(F)c3)[nH]c2c1.
What is the InChIKey of 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid?
The InChIKey is ORQSGZALMKEDBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7F2N3O2/c14-8-1-6(2-9(15)4-8)11-17-10-3-7(13(19)20)5-16-12(10)18-11/h1-5H,(H,19,20)(H,16,17,18).
What are the key properties of 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid?
2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid has a molecular weight of 275.21 g/mol, XLogP of 2.60, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid is sourced from PubChem (CID 82821137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).