3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one

C9H11NO2S2 — CID 3447830

IUPAC3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2cccs2)N1CCO
InChIInChI=1S/C9H11NO2S2/c11-4-3-10-8(12)6-14-9(10)7-2-1-5-13-7/h1-2,5,9,11H,3-4,6H2
InChIKeyLNKJAIKOSDABML-UHFFFAOYSA-N
MW229.33 g/mol
LogP1.31
Rot. Bonds3

About 3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one

3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one (PubChem CID 3447830) has the molecular formula C9H11NO2S2 and a molecular weight of 229.33 g/mol. Its IUPAC name is 3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
PubChem CID3447830
Molecular FormulaC9H11NO2S2
Molecular Weight229.33 g/mol
Exact Mass229.02
IUPAC Name3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
SMILESO=C1CSC(c2cccs2)N1CCO
InChIInChI=1S/C9H11NO2S2/c11-4-3-10-8(12)6-14-9(10)7-2-1-5-13-7/h1-2,5,9,11H,3-4,6H2
InChIKeyLNKJAIKOSDABML-UHFFFAOYSA-N
XLogP1.31
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-3-[3-[(2S)-4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl]propyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 10093008
methyl 3-(4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl)propanoate
CID 3873645
3-(2-phenoxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 4657694
3-[2-(4-propanoylpiperazin-1-yl)ethyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 42815016
N-ethyl-2-(4-oxo-2-thiophen-2-yl-1,3-thiazolidin-3-yl)acetamide
CID 42815196
3-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 3873599
3-[(2-fluorophenyl)methyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 3741447
3-(2-hydroxyethyl)-2-[2-(trifluoromethyl)phenyl]-1,3-thiazolidin-4-one
CID 5008068
2-thiophen-2-yl-3-[(2,4,6-trimethoxyphenyl)methyl]-1,3-thiazolidin-4-one
CID 3873596
3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one
CID 23995593
2-(5-chlorothiophen-2-yl)-3-(3-hydroxypropyl)-1,3-thiazolidin-4-one
CID 3768895
3-[(2,3-dimethoxyphenyl)methyl]-2-thiophen-2-yl-1,3-thiazolidin-4-one
CID 3313737

Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The IUPAC name of 3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one (CID 3447830) is 3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one is O=C1CSC(c2cccs2)N1CCO.
What is the InChIKey of 3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
The InChIKey is LNKJAIKOSDABML-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2S2/c11-4-3-10-8(12)6-14-9(10)7-2-1-5-13-7/h1-2,5,9,11H,3-4,6H2.
What are the key properties of 3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one?
3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one has a molecular weight of 229.33 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyethyl)-2-thiophen-2-yl-1,3-thiazolidin-4-one is sourced from PubChem (CID 3447830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).