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

C14H11N3O3 — CID 82821325

IUPAC2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
SMILESCOc1cccc(-c2nc3ncc(C(=O)O)cc3[nH]2)c1
InChIInChI=1S/C14H11N3O3/c1-20-10-4-2-3-8(5-10)12-16-11-6-9(14(18)19)7-15-13(11)17-12/h2-7H,1H3,(H,18,19)(H,15,16,17)
InChIKeyRUZCDZJGWYVIIW-UHFFFAOYSA-N
MW269.26 g/mol
LogP2.33
Rot. Bonds3

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

2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid (PubChem CID 82821325) has the molecular formula C14H11N3O3 and a molecular weight of 269.26 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
PubChem CID82821325
Molecular FormulaC14H11N3O3
Molecular Weight269.26 g/mol
Exact Mass269.08
IUPAC Name2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
SMILESCOc1cccc(-c2nc3ncc(C(=O)O)cc3[nH]2)c1
InChIInChI=1S/C14H11N3O3/c1-20-10-4-2-3-8(5-10)12-16-11-6-9(14(18)19)7-15-13(11)17-12/h2-7H,1H3,(H,18,19)(H,15,16,17)
InChIKeyRUZCDZJGWYVIIW-UHFFFAOYSA-N
XLogP2.33
TPSA88.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82821422
6-bromo-2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine;2,2,2-trifluoroacetic acid
CID 69377270
2-(3-methoxy-4-methylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82795992
2-(3-fluoro-4-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82796325
2-(4-ethoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82796070
2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82821137
2-(3-methoxythiophen-2-yl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82821331
2-thiophen-3-yl-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82820668
2-chloro-8-(3-methoxyphenyl)-7H-purine
CID 24904050
2-(4-methoxyanilino)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 66587024
2-(3-bromo-4-chlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 107989451
2-(2-methylphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid
CID 82821514

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid?
The IUPAC name of 2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid (CID 82821325) is 2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid.
What is the SMILES notation for 2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid?
The canonical SMILES for 2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid is COc1cccc(-c2nc3ncc(C(=O)O)cc3[nH]2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid?
The InChIKey is RUZCDZJGWYVIIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O3/c1-20-10-4-2-3-8(5-10)12-16-11-6-9(14(18)19)7-15-13(11)17-12/h2-7H,1H3,(H,18,19)(H,15,16,17).
What are the key properties of 2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid?
2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid has a molecular weight of 269.26 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxylic acid is sourced from PubChem (CID 82821325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).