2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid

C8H5ClN2O2 — CID 2360195

IUPAC2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid
SMILESO=C(O)c1c(Cl)nc2ccccn12
InChIInChI=1S/C8H5ClN2O2/c9-7-6(8(12)13)11-4-2-1-3-5(11)10-7/h1-4H,(H,12,13)
InChIKeyCPVGSYXZACHSFJ-UHFFFAOYSA-N
MW196.59 g/mol
LogP1.69
Rot. Bonds1

About 2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid

2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 2360195) has the molecular formula C8H5ClN2O2 and a molecular weight of 196.59 g/mol. Its IUPAC name is 2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid
PubChem CID2360195
Molecular FormulaC8H5ClN2O2
Molecular Weight196.59 g/mol
Exact Mass196.00
IUPAC Name2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid
SMILESO=C(O)c1c(Cl)nc2ccccn12
InChIInChI=1S/C8H5ClN2O2/c9-7-6(8(12)13)11-4-2-1-3-5(11)10-7/h1-4H,(H,12,13)
InChIKeyCPVGSYXZACHSFJ-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 2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid?
The IUPAC name of 2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid (CID 2360195) is 2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid?
The canonical SMILES for 2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid is O=C(O)c1c(Cl)nc2ccccn12.
What is the InChIKey of 2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid?
The InChIKey is CPVGSYXZACHSFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5ClN2O2/c9-7-6(8(12)13)11-4-2-1-3-5(11)10-7/h1-4H,(H,12,13).
What are the key properties of 2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid?
2-chloroimidazo[1,2-a]pyridine-3-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 2-chloroimidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 2360195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).