5-ethenyl-2,4-dimethyl-1,3-thiazole

C7H9NS — CID 5362563

IUPAC5-ethenyl-2,4-dimethyl-1,3-thiazole
SMILESC=Cc1sc(C)nc1C
InChIInChI=1S/C7H9NS/c1-4-7-5(2)8-6(3)9-7/h4H,1H2,2-3H3
InChIKeyMLBCDQHOBLVBQD-UHFFFAOYSA-N
MW139.22 g/mol
LogP2.40
Rot. Bonds1

About 5-ethenyl-2,4-dimethyl-1,3-thiazole

5-ethenyl-2,4-dimethyl-1,3-thiazole (PubChem CID 5362563) has the molecular formula C7H9NS and a molecular weight of 139.22 g/mol. Its IUPAC name is 5-ethenyl-2,4-dimethyl-1,3-thiazole.

Molecular Properties

Compound Name5-ethenyl-2,4-dimethyl-1,3-thiazole
PubChem CID5362563
Molecular FormulaC7H9NS
Molecular Weight139.22 g/mol
Exact Mass139.05
IUPAC Name5-ethenyl-2,4-dimethyl-1,3-thiazole
SMILESC=Cc1sc(C)nc1C
InChIInChI=1S/C7H9NS/c1-4-7-5(2)8-6(3)9-7/h4H,1H2,2-3H3
InChIKeyMLBCDQHOBLVBQD-UHFFFAOYSA-N
XLogP2.40
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.22
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-ethenyl-2,4-dimethyl-1,3-thiazole 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-ethenyl-2,4-dimethyl-1,3-thiazole?
The IUPAC name of 5-ethenyl-2,4-dimethyl-1,3-thiazole (CID 5362563) is 5-ethenyl-2,4-dimethyl-1,3-thiazole.
What is the SMILES notation for 5-ethenyl-2,4-dimethyl-1,3-thiazole?
The canonical SMILES for 5-ethenyl-2,4-dimethyl-1,3-thiazole is C=Cc1sc(C)nc1C.
What is the InChIKey of 5-ethenyl-2,4-dimethyl-1,3-thiazole?
The InChIKey is MLBCDQHOBLVBQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NS/c1-4-7-5(2)8-6(3)9-7/h4H,1H2,2-3H3.
What are the key properties of 5-ethenyl-2,4-dimethyl-1,3-thiazole?
5-ethenyl-2,4-dimethyl-1,3-thiazole has a molecular weight of 139.22 g/mol, XLogP of 2.40, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-2,4-dimethyl-1,3-thiazole is sourced from PubChem (CID 5362563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).