3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid

C8H5ClN2O2 — CID 83831277

IUPAC3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid
SMILESO=C(O)c1cccn2c(Cl)ncc12
InChIInChI=1S/C8H5ClN2O2/c9-8-10-4-6-5(7(12)13)2-1-3-11(6)8/h1-4H,(H,12,13)
InChIKeyRQRSQSGEAGCJOL-UHFFFAOYSA-N
MW196.59 g/mol
LogP1.69
Rot. Bonds1

About 3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid

3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid (PubChem CID 83831277) has the molecular formula C8H5ClN2O2 and a molecular weight of 196.59 g/mol. Its IUPAC name is 3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid.

Molecular Properties

Compound Name3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid
PubChem CID83831277
Molecular FormulaC8H5ClN2O2
Molecular Weight196.59 g/mol
Exact Mass196.00
IUPAC Name3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid
SMILESO=C(O)c1cccn2c(Cl)ncc12
InChIInChI=1S/C8H5ClN2O2/c9-8-10-4-6-5(7(12)13)2-1-3-11(6)8/h1-4H,(H,12,13)
InChIKeyRQRSQSGEAGCJOL-UHFFFAOYSA-N
XLogP1.69
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.59
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid?
The IUPAC name of 3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid (CID 83831277) is 3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid.
What is the SMILES notation for 3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid?
The canonical SMILES for 3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid is O=C(O)c1cccn2c(Cl)ncc12.
What is the InChIKey of 3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid?
The InChIKey is RQRSQSGEAGCJOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5ClN2O2/c9-8-10-4-6-5(7(12)13)2-1-3-11(6)8/h1-4H,(H,12,13).
What are the key properties of 3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid?
3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid has a molecular weight of 196.59 g/mol, XLogP of 1.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid is sourced from PubChem (CID 83831277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).