5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one

C15H21N3O3 — CID 134305994

IUPAC5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one
SMILESCOCC(COC)n1ccnc1-c1cc(C)c(=O)n(C)c1
InChIInChI=1S/C15H21N3O3/c1-11-7-12(8-17(2)15(11)19)14-16-5-6-18(14)13(9-20-3)10-21-4/h5-8,13H,9-10H2,1-4H3
InChIKeyZYEVNVBNADIMLN-UHFFFAOYSA-N
MW291.35 g/mol
LogP1.39
Rot. Bonds6

About 5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one

5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one (PubChem CID 134305994) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one.

Molecular Properties

Compound Name5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one
PubChem CID134305994
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one
SMILESCOCC(COC)n1ccnc1-c1cc(C)c(=O)n(C)c1
InChIInChI=1S/C15H21N3O3/c1-11-7-12(8-17(2)15(11)19)14-16-5-6-18(14)13(9-20-3)10-21-4/h5-8,13H,9-10H2,1-4H3
InChIKeyZYEVNVBNADIMLN-UHFFFAOYSA-N
XLogP1.39
TPSA58.28 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-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 5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one?
The IUPAC name of 5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one (CID 134305994) is 5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one.
What is the SMILES notation for 5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one?
The canonical SMILES for 5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one is COCC(COC)n1ccnc1-c1cc(C)c(=O)n(C)c1.
What is the InChIKey of 5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one?
The InChIKey is ZYEVNVBNADIMLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-11-7-12(8-17(2)15(11)19)14-16-5-6-18(14)13(9-20-3)10-21-4/h5-8,13H,9-10H2,1-4H3.
What are the key properties of 5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one?
5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one has a molecular weight of 291.35 g/mol, XLogP of 1.39, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(1,3-dimethoxypropan-2-yl)imidazol-2-yl]-1,3-dimethylpyridin-2-one is sourced from PubChem (CID 134305994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).