3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide

C13H15ClN2O2S — CID 24712211

IUPAC3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide
SMILESCNC(=O)CCN1C(=O)CSC1c1ccccc1Cl
InChIInChI=1S/C13H15ClN2O2S/c1-15-11(17)6-7-16-12(18)8-19-13(16)9-4-2-3-5-10(9)14/h2-5,13H,6-8H2,1H3,(H,15,17)
InChIKeyOVANHQNZNCDRHU-UHFFFAOYSA-N
MW298.80 g/mol
LogP2.05
Rot. Bonds4

About 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide

3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide (PubChem CID 24712211) has the molecular formula C13H15ClN2O2S and a molecular weight of 298.80 g/mol. Its IUPAC name is 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide.

Molecular Properties

Compound Name3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide
PubChem CID24712211
Molecular FormulaC13H15ClN2O2S
Molecular Weight298.80 g/mol
Exact Mass298.05
IUPAC Name3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide
SMILESCNC(=O)CCN1C(=O)CSC1c1ccccc1Cl
InChIInChI=1S/C13H15ClN2O2S/c1-15-11(17)6-7-16-12(18)8-19-13(16)9-4-2-3-5-10(9)14/h2-5,13H,6-8H2,1H3,(H,15,17)
InChIKeyOVANHQNZNCDRHU-UHFFFAOYSA-N
XLogP2.05
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.80
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide 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

2-(4-Chlorophenyl)-2-methyl-1,3-thiazolidin-4-one
CID 3127481
Thiazolidine, 2-(o-chlorophenyl)-
CID 2771065
2-(4-Chlorophenyl)-5-methyl-1,3-thiazolidin-4-one
CID 2828158
2-(2,4-Dichlorophenyl)-5-methyl-1,3-thiazolidin-4-one
CID 2872053
2-(2-Chlorophenyl)-1,3-thiazolidin-4-one
CID 3121283
N-[(2,6-dichlorophenyl)methyl]-N',N'-dimethylpropanediamide
CID 44523130
2-(4-Chlorophenyl)-1,3-thiazolidin-4-one
CID 2840721
2-(3-Chlorophenyl)-5-methyl-1,3-thiazolidin-4-one
CID 2840110
2-(3-Chlorophenyl)-3-[3-(dimethylamino)propyl]-1,3-thiazolidin-4-one
CID 2860026
2-(2-Chlorophenyl)-5-methyl-1,3-thiazolidin-4-one
CID 2872214
N-[(2-Chlorophenyl)methyl]-3-{[(3-chlorophenyl)methyl]sulfanyl}propanamide
CID 4219372
N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
CID 9467651

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide?
The IUPAC name of 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide (CID 24712211) is 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide.
What is the SMILES notation for 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide?
The canonical SMILES for 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide is CNC(=O)CCN1C(=O)CSC1c1ccccc1Cl.
What is the InChIKey of 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide?
The InChIKey is OVANHQNZNCDRHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2O2S/c1-15-11(17)6-7-16-12(18)8-19-13(16)9-4-2-3-5-10(9)14/h2-5,13H,6-8H2,1H3,(H,15,17).
What are the key properties of 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide?
3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide has a molecular weight of 298.80 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylpropanamide is sourced from PubChem (CID 24712211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).