2-ethyl-2,3-dihydro-1,3-thiazole

C5H9NS — CID 19974235

IUPAC2-ethyl-2,3-dihydro-1,3-thiazole
SMILESCCC1NC=CS1
InChIInChI=1S/C5H9NS/c1-2-5-6-3-4-7-5/h3-6H,2H2,1H3
InChIKeyHCPDYJWQZAAGIM-UHFFFAOYSA-N
MW115.20 g/mol
LogP1.53
Rot. Bonds1

About 2-ethyl-2,3-dihydro-1,3-thiazole

2-ethyl-2,3-dihydro-1,3-thiazole (PubChem CID 19974235) has the molecular formula C5H9NS and a molecular weight of 115.20 g/mol. Its IUPAC name is 2-ethyl-2,3-dihydro-1,3-thiazole.

Molecular Properties

Compound Name2-ethyl-2,3-dihydro-1,3-thiazole
PubChem CID19974235
Molecular FormulaC5H9NS
Molecular Weight115.20 g/mol
Exact Mass115.05
IUPAC Name2-ethyl-2,3-dihydro-1,3-thiazole
SMILESCCC1NC=CS1
InChIInChI=1S/C5H9NS/c1-2-5-6-3-4-7-5/h3-6H,2H2,1H3
InChIKeyHCPDYJWQZAAGIM-UHFFFAOYSA-N
XLogP1.53
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.20
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-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 2-ethyl-2,3-dihydro-1,3-thiazole?
The IUPAC name of 2-ethyl-2,3-dihydro-1,3-thiazole (CID 19974235) is 2-ethyl-2,3-dihydro-1,3-thiazole.
What is the SMILES notation for 2-ethyl-2,3-dihydro-1,3-thiazole?
The canonical SMILES for 2-ethyl-2,3-dihydro-1,3-thiazole is CCC1NC=CS1.
What is the InChIKey of 2-ethyl-2,3-dihydro-1,3-thiazole?
The InChIKey is HCPDYJWQZAAGIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NS/c1-2-5-6-3-4-7-5/h3-6H,2H2,1H3.
What are the key properties of 2-ethyl-2,3-dihydro-1,3-thiazole?
2-ethyl-2,3-dihydro-1,3-thiazole has a molecular weight of 115.20 g/mol, XLogP of 1.53, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2,3-dihydro-1,3-thiazole is sourced from PubChem (CID 19974235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).