1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid

C14H9ClN2O2 — CID 83870930

IUPAC1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid
SMILESO=C(O)c1ccn2c(-c3ccccc3)nc(Cl)c2c1
InChIInChI=1S/C14H9ClN2O2/c15-12-11-8-10(14(18)19)6-7-17(11)13(16-12)9-4-2-1-3-5-9/h1-8H,(H,18,19)
InChIKeySDVPNHYAGFZCBZ-UHFFFAOYSA-N
MW272.69 g/mol
LogP3.35
Rot. Bonds2

About 1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid

1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid (PubChem CID 83870930) has the molecular formula C14H9ClN2O2 and a molecular weight of 272.69 g/mol. Its IUPAC name is 1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid.

Molecular Properties

Compound Name1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid
PubChem CID83870930
Molecular FormulaC14H9ClN2O2
Molecular Weight272.69 g/mol
Exact Mass272.04
IUPAC Name1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid
SMILESO=C(O)c1ccn2c(-c3ccccc3)nc(Cl)c2c1
InChIInChI=1S/C14H9ClN2O2/c15-12-11-8-10(14(18)19)6-7-17(11)13(16-12)9-4-2-1-3-5-9/h1-8H,(H,18,19)
InChIKeySDVPNHYAGFZCBZ-UHFFFAOYSA-N
XLogP3.35
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.69
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-chloro-3-(4-fluorophenyl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117251989
1-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117251877
1-formyl-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid
CID 84742895
1-chloro-3-(5-methylthiophen-2-yl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117251715
3-pyridin-3-ylimidazo[1,5-a]pyridine-1,7-dicarboxylic acid
CID 117251777
3-(aminomethyl)-1-chloroimidazo[1,5-a]pyridine-7-carboxylic acid
CID 84740466
methyl 1-chloro-3-(4-fluorophenyl)imidazo[1,5-a]pyridine-7-carboxylate
CID 117251991
1-chloro-3-(thiophen-2-ylmethyl)imidazo[1,5-a]pyridine-7-carboxylic acid
CID 117252076
1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridin-7-ol
CID 117252012
1-chloro-3-(4-methylphenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
CID 117251411
1-chloro-3-(4-chlorophenyl)imidazo[1,5-a]pyridine-6-carboxylic acid
CID 117251414
3-hydroxy-2-phenylbenzimidazole-5-carboxylic acid
CID 10083635

Frequently Asked Questions

What is the IUPAC name of 1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid?
The IUPAC name of 1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid (CID 83870930) is 1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid.
What is the SMILES notation for 1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid?
The canonical SMILES for 1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid is O=C(O)c1ccn2c(-c3ccccc3)nc(Cl)c2c1.
What is the InChIKey of 1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid?
The InChIKey is SDVPNHYAGFZCBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2O2/c15-12-11-8-10(14(18)19)6-7-17(11)13(16-12)9-4-2-1-3-5-9/h1-8H,(H,18,19).
What are the key properties of 1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid?
1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid has a molecular weight of 272.69 g/mol, XLogP of 3.35, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-3-phenylimidazo[1,5-a]pyridine-7-carboxylic acid is sourced from PubChem (CID 83870930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).