3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one

C11H12N2OS — CID 115610775

IUPAC3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one
SMILESCc1nc(Cn2cccc(C)c2=O)cs1
InChIInChI=1S/C11H12N2OS/c1-8-4-3-5-13(11(8)14)6-10-7-15-9(2)12-10/h3-5,7H,6H2,1-2H3
InChIKeyGZQOSXOGGFUZIS-UHFFFAOYSA-N
MW220.30 g/mol
LogP1.97
Rot. Bonds2

About 3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one

3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one (PubChem CID 115610775) has the molecular formula C11H12N2OS and a molecular weight of 220.30 g/mol. Its IUPAC name is 3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one.

Molecular Properties

Compound Name3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one
PubChem CID115610775
Molecular FormulaC11H12N2OS
Molecular Weight220.30 g/mol
Exact Mass220.07
IUPAC Name3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one
SMILESCc1nc(Cn2cccc(C)c2=O)cs1
InChIInChI=1S/C11H12N2OS/c1-8-4-3-5-13(11(8)14)6-10-7-15-9(2)12-10/h3-5,7H,6H2,1-2H3
InChIKeyGZQOSXOGGFUZIS-UHFFFAOYSA-N
XLogP1.97
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-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

Related Compounds

4-[(2,3-dimethylpyrrol-1-yl)methyl]-2-methyl-1,3-thiazole
CID 141136037
2-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridazin-3-one
CID 141198028
3-methyl-1-(thiophen-3-ylmethyl)pyridin-2-one
CID 116621489
N-[[1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrrol-2-yl]methyl]cyclopropanamine
CID 66403179
2-methyl-4-[(2,3,4-trimethylpyrrol-1-yl)methyl]-1,3-thiazole
CID 63926670
3-[(2-methyl-1,3-thiazol-4-yl)methyl]thieno[3,2-d]pyrimidin-4-one
CID 47160423
3-amino-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-4-one
CID 82991105
4-(chloromethyl)-2-methyl-1,3-thiazole;dihydrochloride
CID 133061330
1-[(1-ethylimidazol-2-yl)methyl]-3-methylpyridin-2-one
CID 115616696
1-[[3-(aminomethyl)phenyl]methyl]-3-methylpyridin-2-one
CID 63172505
3-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazolidine-2,4-dione
CID 103601183
4-methyl-3-[(2-methyl-1,3-thiazol-4-yl)methyl]-1H-benzimidazole-2-thione
CID 115551790

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one?
The IUPAC name of 3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one (CID 115610775) is 3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one.
What is the SMILES notation for 3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one?
The canonical SMILES for 3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one is Cc1nc(Cn2cccc(C)c2=O)cs1.
What is the InChIKey of 3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one?
The InChIKey is GZQOSXOGGFUZIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2OS/c1-8-4-3-5-13(11(8)14)6-10-7-15-9(2)12-10/h3-5,7H,6H2,1-2H3.
What are the key properties of 3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one?
3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one has a molecular weight of 220.30 g/mol, XLogP of 1.97, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-one is sourced from PubChem (CID 115610775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).