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

C14H17ClN2O2S — CID 24711895

IUPAC3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CCN1C(=O)CSC1c1ccccc1Cl
InChIInChI=1S/C14H17ClN2O2S/c1-16(2)12(18)7-8-17-13(19)9-20-14(17)10-5-3-4-6-11(10)15/h3-6,14H,7-9H2,1-2H3
InChIKeyBPXXJUZIFGUQNY-UHFFFAOYSA-N
MW312.82 g/mol
LogP2.39
Rot. Bonds4

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

3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide (PubChem CID 24711895) has the molecular formula C14H17ClN2O2S and a molecular weight of 312.82 g/mol. Its IUPAC name is 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide
PubChem CID24711895
Molecular FormulaC14H17ClN2O2S
Molecular Weight312.82 g/mol
Exact Mass312.07
IUPAC Name3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide
SMILESCN(C)C(=O)CCN1C(=O)CSC1c1ccccc1Cl
InChIInChI=1S/C14H17ClN2O2S/c1-16(2)12(18)7-8-17-13(19)9-20-14(17)10-5-3-4-6-11(10)15/h3-6,14H,7-9H2,1-2H3
InChIKeyBPXXJUZIFGUQNY-UHFFFAOYSA-N
XLogP2.39
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.82
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-Chlorophenyl)-5-methyl-1,3-thiazolidin-4-one
CID 2828158
4-Thiazolidinone, 2-(4-chlorophenyl)-3-cyclohexyl-
CID 3272082
2-phenyl-3-(N,N-dimethylaminopropyl)-1,3-thiazolidin-4-one
CID 126623
2-(2,4-Dichlorophenyl)-5-methyl-1,3-thiazolidin-4-one
CID 2872053
2-(2-Chlorophenyl)-1,3-thiazolidin-4-one
CID 3121283
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
3-[3-(Dimethylamino)propyl]-2-(4-fluorophenyl)-1,3-thiazolidin-4-one;hydrochloride
CID 2872049
2-(2-Chlorophenyl)-5-methyl-1,3-thiazolidin-4-one
CID 2872214
3-[3-(Dimethylamino)propyl]-2-(4-methylphenyl)-1,3-thiazolidin-4-one;hydrochloride
CID 5341962
3-[3-(Dimethylamino)propyl]-2-(3-fluorophenyl)-1,3-thiazolidin-4-one;hydrochloride
CID 49860519

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide?
The IUPAC name of 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide (CID 24711895) is 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide.
What is the SMILES notation for 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide?
The canonical SMILES for 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide is CN(C)C(=O)CCN1C(=O)CSC1c1ccccc1Cl.
What is the InChIKey of 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide?
The InChIKey is BPXXJUZIFGUQNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O2S/c1-16(2)12(18)7-8-17-13(19)9-20-14(17)10-5-3-4-6-11(10)15/h3-6,14H,7-9H2,1-2H3.
What are the key properties of 3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide?
3-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N,N-dimethylpropanamide has a molecular weight of 312.82 g/mol, XLogP of 2.39, 4 rotatable bonds, 0 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,N-dimethylpropanamide is sourced from PubChem (CID 24711895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).