(2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one

C13H14N2O — CID 92982225

IUPAC(2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one
SMILESO=C1CCCC[C@H]1c1ccc2nccn2c1
InChIInChI=1S/C13H14N2O/c16-12-4-2-1-3-11(12)10-5-6-13-14-7-8-15(13)9-10/h5-9,11H,1-4H2/t11-/m0/s1
InChIKeyUVUOVBKYCRDAHA-NSHDSACASA-N
MW214.27 g/mol
LogP2.56
Rot. Bonds1

About (2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one

(2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one (PubChem CID 92982225) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is (2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one.

Molecular Properties

Compound Name(2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one
PubChem CID92982225
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name(2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one
SMILESO=C1CCCC[C@H]1c1ccc2nccn2c1
InChIInChI=1S/C13H14N2O/c16-12-4-2-1-3-11(12)10-5-6-13-14-7-8-15(13)9-10/h5-9,11H,1-4H2/t11-/m0/s1
InChIKeyUVUOVBKYCRDAHA-NSHDSACASA-N
XLogP2.56
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-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 (2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one?
The IUPAC name of (2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one (CID 92982225) is (2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one.
What is the SMILES notation for (2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one?
The canonical SMILES for (2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one is O=C1CCCC[C@H]1c1ccc2nccn2c1.
What is the InChIKey of (2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one?
The InChIKey is UVUOVBKYCRDAHA-NSHDSACASA-N. The full InChI is InChI=1S/C13H14N2O/c16-12-4-2-1-3-11(12)10-5-6-13-14-7-8-15(13)9-10/h5-9,11H,1-4H2/t11-/m0/s1.
What are the key properties of (2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one?
(2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one has a molecular weight of 214.27 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-imidazo[1,2-a]pyridin-6-ylcyclohexan-1-one is sourced from PubChem (CID 92982225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).