4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one

C24H22ClN3O2 — CID 127025096

IUPAC4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one
SMILESCc1cn(-c2ccc3nc(C4CC4)c(C)n3c2)c(=O)cc1OCc1ccc(Cl)cc1
InChIInChI=1S/C24H22ClN3O2/c1-15-12-28(23(29)11-21(15)30-14-17-3-7-19(25)8-4-17)20-9-10-22-26-24(18-5-6-18)16(2)27(22)13-20/h3-4,7-13,18H,5-6,14H2,1-2H3
InChIKeyKMILLQAPTCJKSV-UHFFFAOYSA-N
MW419.91 g/mol
LogP5.21
Rot. Bonds5

About 4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one

4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one (PubChem CID 127025096) has the molecular formula C24H22ClN3O2 and a molecular weight of 419.91 g/mol. Its IUPAC name is 4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one.

Molecular Properties

Compound Name4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one
PubChem CID127025096
Molecular FormulaC24H22ClN3O2
Molecular Weight419.91 g/mol
Exact Mass419.14
IUPAC Name4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one
SMILESCc1cn(-c2ccc3nc(C4CC4)c(C)n3c2)c(=O)cc1OCc1ccc(Cl)cc1
InChIInChI=1S/C24H22ClN3O2/c1-15-12-28(23(29)11-21(15)30-14-17-3-7-19(25)8-4-17)20-9-10-22-26-24(18-5-6-18)16(2)27(22)13-20/h3-4,7-13,18H,5-6,14H2,1-2H3
InChIKeyKMILLQAPTCJKSV-UHFFFAOYSA-N
XLogP5.21
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500419.91
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-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 4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one?
The IUPAC name of 4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one (CID 127025096) is 4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one.
What is the SMILES notation for 4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one?
The canonical SMILES for 4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one is Cc1cn(-c2ccc3nc(C4CC4)c(C)n3c2)c(=O)cc1OCc1ccc(Cl)cc1.
What is the InChIKey of 4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one?
The InChIKey is KMILLQAPTCJKSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22ClN3O2/c1-15-12-28(23(29)11-21(15)30-14-17-3-7-19(25)8-4-17)20-9-10-22-26-24(18-5-6-18)16(2)27(22)13-20/h3-4,7-13,18H,5-6,14H2,1-2H3.
What are the key properties of 4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one?
4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one has a molecular weight of 419.91 g/mol, XLogP of 5.21, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-chlorophenyl)methoxy]-1-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-5-methylpyridin-2-one is sourced from PubChem (CID 127025096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).