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

C14H16N2O2S — CID 23995593

IUPAC3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one
SMILESCn1cc(C2SCC(=O)N2CCO)c2ccccc21
InChIInChI=1S/C14H16N2O2S/c1-15-8-11(10-4-2-3-5-12(10)15)14-16(6-7-17)13(18)9-19-14/h2-5,8,14,17H,6-7,9H2,1H3
InChIKeyNEUAANDALGVXRC-UHFFFAOYSA-N
MW276.36 g/mol
LogP1.74
Rot. Bonds3

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

3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one (PubChem CID 23995593) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is 3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one
PubChem CID23995593
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC Name3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one
SMILESCn1cc(C2SCC(=O)N2CCO)c2ccccc21
InChIInChI=1S/C14H16N2O2S/c1-15-8-11(10-4-2-3-5-12(10)15)14-16(6-7-17)13(18)9-19-14/h2-5,8,14,17H,6-7,9H2,1H3
InChIKeyNEUAANDALGVXRC-UHFFFAOYSA-N
XLogP1.74
TPSA45.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one 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 3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one?
The IUPAC name of 3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one (CID 23995593) is 3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one is Cn1cc(C2SCC(=O)N2CCO)c2ccccc21.
What is the InChIKey of 3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one?
The InChIKey is NEUAANDALGVXRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-15-8-11(10-4-2-3-5-12(10)15)14-16(6-7-17)13(18)9-19-14/h2-5,8,14,17H,6-7,9H2,1H3.
What are the key properties of 3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one?
3-(2-hydroxyethyl)-2-(1-methylindol-3-yl)-1,3-thiazolidin-4-one has a molecular weight of 276.36 g/mol, XLogP of 1.74, 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-(1-methylindol-3-yl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 23995593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).