5-ethenyl-2,3-dihydro-1,3-thiazole

C5H7NS — CID 134536833

IUPAC5-ethenyl-2,3-dihydro-1,3-thiazole
SMILESC=CC1=CNCS1
InChIInChI=1S/C5H7NS/c1-2-5-3-6-4-7-5/h2-3,6H,1,4H2
InChIKeyKWLBPMZTEDCDBX-UHFFFAOYSA-N
MW113.18 g/mol
LogP1.31
Rot. Bonds1

About 5-ethenyl-2,3-dihydro-1,3-thiazole

5-ethenyl-2,3-dihydro-1,3-thiazole (PubChem CID 134536833) has the molecular formula C5H7NS and a molecular weight of 113.18 g/mol. Its IUPAC name is 5-ethenyl-2,3-dihydro-1,3-thiazole.

Molecular Properties

Compound Name5-ethenyl-2,3-dihydro-1,3-thiazole
PubChem CID134536833
Molecular FormulaC5H7NS
Molecular Weight113.18 g/mol
Exact Mass113.03
IUPAC Name5-ethenyl-2,3-dihydro-1,3-thiazole
SMILESC=CC1=CNCS1
InChIInChI=1S/C5H7NS/c1-2-5-3-6-4-7-5/h2-3,6H,1,4H2
InChIKeyKWLBPMZTEDCDBX-UHFFFAOYSA-N
XLogP1.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.18
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-ethenyl-2,3-dihydro-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-2,3-dihydro-1,3-thiazole?
The IUPAC name of 5-ethenyl-2,3-dihydro-1,3-thiazole (CID 134536833) is 5-ethenyl-2,3-dihydro-1,3-thiazole.
What is the SMILES notation for 5-ethenyl-2,3-dihydro-1,3-thiazole?
The canonical SMILES for 5-ethenyl-2,3-dihydro-1,3-thiazole is C=CC1=CNCS1.
What is the InChIKey of 5-ethenyl-2,3-dihydro-1,3-thiazole?
The InChIKey is KWLBPMZTEDCDBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NS/c1-2-5-3-6-4-7-5/h2-3,6H,1,4H2.
What are the key properties of 5-ethenyl-2,3-dihydro-1,3-thiazole?
5-ethenyl-2,3-dihydro-1,3-thiazole has a molecular weight of 113.18 g/mol, XLogP of 1.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-2,3-dihydro-1,3-thiazole is sourced from PubChem (CID 134536833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).