3-chloro-1H-imidazo[1,2-a]pyridin-7-one

C7H5ClN2O — CID 131839727

IUPAC3-chloro-1H-imidazo[1,2-a]pyridin-7-one
SMILESO=c1ccn2c(Cl)c[nH]c2c1
InChIInChI=1S/C7H5ClN2O/c8-6-4-9-7-3-5(11)1-2-10(6)7/h1-4,9H
InChIKeyLPQCDZSALGIEOR-UHFFFAOYSA-N
MW168.58 g/mol
LogP1.28
Rot. Bonds

About 3-chloro-1H-imidazo[1,2-a]pyridin-7-one

3-chloro-1H-imidazo[1,2-a]pyridin-7-one (PubChem CID 131839727) has the molecular formula C7H5ClN2O and a molecular weight of 168.58 g/mol. Its IUPAC name is 3-chloro-1H-imidazo[1,2-a]pyridin-7-one.

Molecular Properties

Compound Name3-chloro-1H-imidazo[1,2-a]pyridin-7-one
PubChem CID131839727
Molecular FormulaC7H5ClN2O
Molecular Weight168.58 g/mol
Exact Mass168.01
IUPAC Name3-chloro-1H-imidazo[1,2-a]pyridin-7-one
SMILESO=c1ccn2c(Cl)c[nH]c2c1
InChIInChI=1S/C7H5ClN2O/c8-6-4-9-7-3-5(11)1-2-10(6)7/h1-4,9H
InChIKeyLPQCDZSALGIEOR-UHFFFAOYSA-N
XLogP1.28
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.58
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-chloro-1H-imidazo[1,2-a]pyridin-7-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-chloro-1H-imidazo[1,2-a]pyridin-7-one?
The IUPAC name of 3-chloro-1H-imidazo[1,2-a]pyridin-7-one (CID 131839727) is 3-chloro-1H-imidazo[1,2-a]pyridin-7-one.
What is the SMILES notation for 3-chloro-1H-imidazo[1,2-a]pyridin-7-one?
The canonical SMILES for 3-chloro-1H-imidazo[1,2-a]pyridin-7-one is O=c1ccn2c(Cl)c[nH]c2c1.
What is the InChIKey of 3-chloro-1H-imidazo[1,2-a]pyridin-7-one?
The InChIKey is LPQCDZSALGIEOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClN2O/c8-6-4-9-7-3-5(11)1-2-10(6)7/h1-4,9H.
What are the key properties of 3-chloro-1H-imidazo[1,2-a]pyridin-7-one?
3-chloro-1H-imidazo[1,2-a]pyridin-7-one has a molecular weight of 168.58 g/mol, XLogP of 1.28, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-1H-imidazo[1,2-a]pyridin-7-one is sourced from PubChem (CID 131839727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).