2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile

C21H11ClFN3O2 — CID 135032509

IUPAC2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile
SMILESN#Cc1cc(C(=O)c2cc(F)ccc2O)cn2cc(-c3ccc(Cl)cc3)nc12
InChIInChI=1S/C21H11ClFN3O2/c22-15-3-1-12(2-4-15)18-11-26-10-14(7-13(9-24)21(26)25-18)20(28)17-8-16(23)5-6-19(17)27/h1-8,10-11,27H
InChIKeyHINFBTATFYYBCT-UHFFFAOYSA-N
MW391.79 g/mol
LogP4.60
Rot. Bonds3

About 2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile

2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile (PubChem CID 135032509) has the molecular formula C21H11ClFN3O2 and a molecular weight of 391.79 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile.

Molecular Properties

Compound Name2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile
PubChem CID135032509
Molecular FormulaC21H11ClFN3O2
Molecular Weight391.79 g/mol
Exact Mass391.05
IUPAC Name2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile
SMILESN#Cc1cc(C(=O)c2cc(F)ccc2O)cn2cc(-c3ccc(Cl)cc3)nc12
InChIInChI=1S/C21H11ClFN3O2/c22-15-3-1-12(2-4-15)18-11-26-10-14(7-13(9-24)21(26)25-18)20(28)17-8-16(23)5-6-19(17)27/h1-8,10-11,27H
InChIKeyHINFBTATFYYBCT-UHFFFAOYSA-N
XLogP4.60
TPSA78.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.79
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile with MolForge

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

Launch Full Analysis

Related Compounds

Aminoimidazo[1,2-a]pyridine deriv. 21
CID 5330639
(5-Fluoro-2-hydroxyphenyl)-pyrimido[1,2-a]benzimidazol-3-ylmethanone
CID 3602941
2-(2-Hydroxy-5-methylbenzoyl)pyrido[1,2-a][1,3]benzimidazole-4-carbonitrile
CID 1484504
5-(6-Chloroimidazo[1,2-a]pyridin-2-yl)-2-hydroxybenzamide
CID 134142195
5-(6-Fluoroimidazo[1,2-a]pyridin-2-yl)-2-hydroxybenzamide
CID 134145427
[2-(4-Chlorophenyl)pyrazolo[1,5-A]pyrimidin-6-YL](2-hydroxyphenyl)methanone
CID 11100185
[2-(4-Chlorophenyl)pyrazolo[1,5-a]pyrimidin-6-yl]-[2-hydroxy-5-(trifluoromethyl)phenyl]methanone
CID 156767588
US9908886, Example 143
CID 89825503
Methyl 2-(4-chlorophenyl)-3-[(2-methoxyphenyl)methyl]imidazo[1,2-a]pyridine-6-carboxylate
CID 51359802
3-[2-(4-Chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-2-fluorobenzoic acid
CID 155537779
1-[2-Fluoro-3-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]ethanone
CID 162643694
1-[4-Fluoro-3-[3-(4-hydroxyphenyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]ethanone
CID 162656157

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile?
The IUPAC name of 2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile (CID 135032509) is 2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile.
What is the SMILES notation for 2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile?
The canonical SMILES for 2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile is N#Cc1cc(C(=O)c2cc(F)ccc2O)cn2cc(-c3ccc(Cl)cc3)nc12.
What is the InChIKey of 2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile?
The InChIKey is HINFBTATFYYBCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H11ClFN3O2/c22-15-3-1-12(2-4-15)18-11-26-10-14(7-13(9-24)21(26)25-18)20(28)17-8-16(23)5-6-19(17)27/h1-8,10-11,27H.
What are the key properties of 2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile?
2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile has a molecular weight of 391.79 g/mol, XLogP of 4.60, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile is sourced from PubChem (CID 135032509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).