4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid

C13H8FN3O2 — CID 76848054

IUPAC4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid
SMILESO=C(O)c1cc2[nH]cnc2c(-c2ccc(F)cc2)n1
InChIInChI=1S/C13H8FN3O2/c14-8-3-1-7(2-4-8)11-12-9(15-6-16-12)5-10(17-11)13(18)19/h1-6H,(H,15,16)(H,18,19)
InChIKeyALWBVSNRGLGEPV-UHFFFAOYSA-N
MW257.22 g/mol
LogP2.46
Rot. Bonds2

About 4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid

4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid (PubChem CID 76848054) has the molecular formula C13H8FN3O2 and a molecular weight of 257.22 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid.

Molecular Properties

Compound Name4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid
PubChem CID76848054
Molecular FormulaC13H8FN3O2
Molecular Weight257.22 g/mol
Exact Mass257.06
IUPAC Name4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid
SMILESO=C(O)c1cc2[nH]cnc2c(-c2ccc(F)cc2)n1
InChIInChI=1S/C13H8FN3O2/c14-8-3-1-7(2-4-8)11-12-9(15-6-16-12)5-10(17-11)13(18)19/h1-6H,(H,15,16)(H,18,19)
InChIKeyALWBVSNRGLGEPV-UHFFFAOYSA-N
XLogP2.46
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.22
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-Benzimidazolecarboxylic acid
CID 459456
2-(4-fluorophenyl)-1H-1,3-benzodiazole-6-carboxylic acid
CID 17010630
3-[4-(4-Methylpiperazin-1-Yl)phenyl]-9h-Pyrrolo[2,3-B:5,4-C']dipyridine-6-Carboxylic Acid
CID 58266559
6-Imidazol-1-ylmethyl-1H-indole-2-carboxylic acid
CID 13663032
methyl 4-(7H-purin-6-ylamino)benzoate
CID 756646
5-Imidazol-1-ylmethyl-1H-indole-2-carboxylic acid
CID 13663031
1-(5-Carboxy-1h-benzo[d]-imidazol-2-ylmethyl)pyridinium chloride
CID 50907898
4-Methyl-3,6,10-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene-11-carboxylic acid
CID 135914622
2-(Pyridin-2-yl)-1H-benzo[d]imidazole-6-carboxylic acid
CID 513895
5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indole-2-carboxylic acid
CID 89858633
7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indole-2-carboxylic acid
CID 89858658
4-[[(1R)-1-cyclobutylethyl]amino]-2-(3-methylphenyl)-3-[[4-(trifluoromethyl)phenyl]methyl]imidazo[4,5-c]pyridine-6-carboxylic acid
CID 90235365

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid?
The IUPAC name of 4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid (CID 76848054) is 4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid.
What is the SMILES notation for 4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid?
The canonical SMILES for 4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid is O=C(O)c1cc2[nH]cnc2c(-c2ccc(F)cc2)n1.
What is the InChIKey of 4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid?
The InChIKey is ALWBVSNRGLGEPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8FN3O2/c14-8-3-1-7(2-4-8)11-12-9(15-6-16-12)5-10(17-11)13(18)19/h1-6H,(H,15,16)(H,18,19).
What are the key properties of 4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid?
4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid has a molecular weight of 257.22 g/mol, XLogP of 2.46, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridine-6-carboxylic acid is sourced from PubChem (CID 76848054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).