1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one

C23H28N4O — CID 44583561

IUPAC1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one
SMILESCc1cccc(C)c1CNc1cc(N2CCCCC2=O)cn2c(C)c(C)nc12
InChIInChI=1S/C23H28N4O/c1-15-8-7-9-16(2)20(15)13-24-21-12-19(26-11-6-5-10-22(26)28)14-27-18(4)17(3)25-23(21)27/h7-9,12,14,24H,5-6,10-11,13H2,1-4H3
InChIKeyLAFOUUWSNUQMPK-UHFFFAOYSA-N
MW376.50 g/mol
LogP4.70
Rot. Bonds4

About 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one

1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one (PubChem CID 44583561) has the molecular formula C23H28N4O and a molecular weight of 376.50 g/mol. Its IUPAC name is 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one.

Molecular Properties

Compound Name1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one
PubChem CID44583561
Molecular FormulaC23H28N4O
Molecular Weight376.50 g/mol
Exact Mass376.23
IUPAC Name1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one
SMILESCc1cccc(C)c1CNc1cc(N2CCCCC2=O)cn2c(C)c(C)nc12
InChIInChI=1S/C23H28N4O/c1-15-8-7-9-16(2)20(15)13-24-21-12-19(26-11-6-5-10-22(26)28)14-27-18(4)17(3)25-23(21)27/h7-9,12,14,24H,5-6,10-11,13H2,1-4H3
InChIKeyLAFOUUWSNUQMPK-UHFFFAOYSA-N
XLogP4.70
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-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 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one?
The IUPAC name of 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one (CID 44583561) is 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one.
What is the SMILES notation for 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one?
The canonical SMILES for 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one is Cc1cccc(C)c1CNc1cc(N2CCCCC2=O)cn2c(C)c(C)nc12.
What is the InChIKey of 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one?
The InChIKey is LAFOUUWSNUQMPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O/c1-15-8-7-9-16(2)20(15)13-24-21-12-19(26-11-6-5-10-22(26)28)14-27-18(4)17(3)25-23(21)27/h7-9,12,14,24H,5-6,10-11,13H2,1-4H3.
What are the key properties of 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one?
1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one has a molecular weight of 376.50 g/mol, XLogP of 4.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]piperidin-2-one is sourced from PubChem (CID 44583561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).