3-ethyl-4-hydroxy-1,3-thiazol-2-one

C5H7NO2S — CID 54276559

IUPAC3-ethyl-4-hydroxy-1,3-thiazol-2-one
SMILESCCn1c(O)csc1=O
InChIInChI=1S/C5H7NO2S/c1-2-6-4(7)3-9-5(6)8/h3,7H,2H2,1H3
InChIKeyRNUUZHJIVNBBCW-UHFFFAOYSA-N
MW145.18 g/mol
LogP0.64
Rot. Bonds1

About 3-ethyl-4-hydroxy-1,3-thiazol-2-one

3-ethyl-4-hydroxy-1,3-thiazol-2-one (PubChem CID 54276559) has the molecular formula C5H7NO2S and a molecular weight of 145.18 g/mol. Its IUPAC name is 3-ethyl-4-hydroxy-1,3-thiazol-2-one.

Molecular Properties

Compound Name3-ethyl-4-hydroxy-1,3-thiazol-2-one
PubChem CID54276559
Molecular FormulaC5H7NO2S
Molecular Weight145.18 g/mol
Exact Mass145.02
IUPAC Name3-ethyl-4-hydroxy-1,3-thiazol-2-one
SMILESCCn1c(O)csc1=O
InChIInChI=1S/C5H7NO2S/c1-2-6-4(7)3-9-5(6)8/h3,7H,2H2,1H3
InChIKeyRNUUZHJIVNBBCW-UHFFFAOYSA-N
XLogP0.64
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.18
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-ethyl-4-hydroxy-1,3-thiazol-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

3-(1-Hydroxyethyl)-1,3-thiazol-2-one
CID 17980711
2-methyl-2H-1,3-thiazole-3-carboxylic acid
CID 22355287
4-Hydroxy-3-prop-2-ynyl-1,3-thiazol-2-one
CID 53699195
4-Hydroxy-3-methyl-1,3-thiazol-2-one
CID 53709471
3-(Bromomethyl)-4-hydroxy-1,3-thiazol-2-one
CID 53892574
3-(2-Bromoethyl)-4-hydroxy-1,3-thiazol-2-one
CID 54406320
4-Hydroxy-3-methyl-1-oxo-1,3-thiazol-2-one
CID 54447903
3-Butyl-4-hydroxy-1,3-thiazol-2-one
CID 56631257
3-Methyl-2-oxo-1,3-thiazol-4-olate
CID 59024639
3-Ethenyl-4-hydroxy-1,3-thiazol-2-one
CID 91061233
3-Ethyl-5-hydroxy-1,3-thiazol-2-one
CID 91228450
5-Hydroxy-3-methyl-1,3-thiazol-2-one
CID 91301993

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-hydroxy-1,3-thiazol-2-one?
The IUPAC name of 3-ethyl-4-hydroxy-1,3-thiazol-2-one (CID 54276559) is 3-ethyl-4-hydroxy-1,3-thiazol-2-one.
What is the SMILES notation for 3-ethyl-4-hydroxy-1,3-thiazol-2-one?
The canonical SMILES for 3-ethyl-4-hydroxy-1,3-thiazol-2-one is CCn1c(O)csc1=O.
What is the InChIKey of 3-ethyl-4-hydroxy-1,3-thiazol-2-one?
The InChIKey is RNUUZHJIVNBBCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO2S/c1-2-6-4(7)3-9-5(6)8/h3,7H,2H2,1H3.
What are the key properties of 3-ethyl-4-hydroxy-1,3-thiazol-2-one?
3-ethyl-4-hydroxy-1,3-thiazol-2-one has a molecular weight of 145.18 g/mol, XLogP of 0.64, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-hydroxy-1,3-thiazol-2-one is sourced from PubChem (CID 54276559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).