3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid

C14H9ClN2O2 — CID 28752075

IUPAC3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESO=C(O)c1nc(-c2ccc(Cl)cc2)n2ccccc12
InChIInChI=1S/C14H9ClN2O2/c15-10-6-4-9(5-7-10)13-16-12(14(18)19)11-3-1-2-8-17(11)13/h1-8H,(H,18,19)
InChIKeyNWPCWCGDJQGRIF-UHFFFAOYSA-N
MW272.69 g/mol
LogP3.35
Rot. Bonds2

About 3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid

3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 28752075) has the molecular formula C14H9ClN2O2 and a molecular weight of 272.69 g/mol. Its IUPAC name is 3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

Compound Name3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
PubChem CID28752075
Molecular FormulaC14H9ClN2O2
Molecular Weight272.69 g/mol
Exact Mass272.04
IUPAC Name3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESO=C(O)c1nc(-c2ccc(Cl)cc2)n2ccccc12
InChIInChI=1S/C14H9ClN2O2/c15-10-6-4-9(5-7-10)13-16-12(14(18)19)11-3-1-2-8-17(11)13/h1-8H,(H,18,19)
InChIKeyNWPCWCGDJQGRIF-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

tert-butyl 3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylate
CID 139192063
3-(1-methylpyrrol-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 82477425
3-(4-chlorophenyl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 84738796
N-[[3-(4-chlorophenyl)imidazo[1,5-a]pyridin-1-yl]methylidene]hydroxylamine
CID 693245
4-(1-chloroimidazo[1,5-a]pyridin-3-yl)phenol
CID 137005619
3-(2-chloroethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 116984026
3-hydrazinylimidazo[1,5-a]pyridine-1-carboxylic acid
CID 116984081
3-phenylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid
CID 117252473
3-methylsulfinylimidazo[1,5-a]pyridine-1-carboxylic acid
CID 21280356
1-chloro-3-(4-fluorophenyl)imidazo[1,5-a]pyridine
CID 117250849
7-bromo-3-(4-methylphenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 84744919
3-(4-fluorophenyl)-N-[(4-fluorophenyl)methyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 70943829

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid (CID 28752075) is 3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid is O=C(O)c1nc(-c2ccc(Cl)cc2)n2ccccc12.
What is the InChIKey of 3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is NWPCWCGDJQGRIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2O2/c15-10-6-4-9(5-7-10)13-16-12(14(18)19)11-3-1-2-8-17(11)13/h1-8H,(H,18,19).
What are the key properties of 3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid?
3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-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 3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 28752075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).