2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide

C12H12F2N2O2S — CID 24712216

IUPAC2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide
SMILESCNC(=O)CN1C(=O)CSC1c1ccc(F)cc1F
InChIInChI=1S/C12H12F2N2O2S/c1-15-10(17)5-16-11(18)6-19-12(16)8-3-2-7(13)4-9(8)14/h2-4,12H,5-6H2,1H3,(H,15,17)
InChIKeyRZSVFRHSWZYWLJ-UHFFFAOYSA-N
MW286.30 g/mol
LogP1.28
Rot. Bonds3

About 2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide

2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide (PubChem CID 24712216) has the molecular formula C12H12F2N2O2S and a molecular weight of 286.30 g/mol. Its IUPAC name is 2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide.

Molecular Properties

Compound Name2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide
PubChem CID24712216
Molecular FormulaC12H12F2N2O2S
Molecular Weight286.30 g/mol
Exact Mass286.06
IUPAC Name2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide
SMILESCNC(=O)CN1C(=O)CSC1c1ccc(F)cc1F
InChIInChI=1S/C12H12F2N2O2S/c1-15-10(17)5-16-11(18)6-19-12(16)8-3-2-7(13)4-9(8)14/h2-4,12H,5-6H2,1H3,(H,15,17)
InChIKeyRZSVFRHSWZYWLJ-UHFFFAOYSA-N
XLogP1.28
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.30
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-fluorophenyl)methyl]-2-[2-(3-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
CID 42814453
N-[2-(dimethylamino)ethyl]-2-[2-(3-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
CID 42814850
N-(3,5-difluorophenyl)-2-(4-oxo-2-phenyl-1,3-thiazolidin-3-yl)acetamide
CID 11302478
2-[2-(3-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide
CID 42814845
methyl 4-[3-[(2,4-difluorophenyl)methyl]-4-oxo-1,3-thiazolidin-2-yl]benzoate
CID 3399752
2-(2,4-difluorophenyl)-3-[4-methyl-1-(4-methylpiperazin-1-yl)-1-oxopentan-2-yl]-1,3-thiazolidin-4-one
CID 42815121
N-[2-(dimethylamino)ethyl]-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
CID 24711902
2-[2-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide
CID 42814442
1-[(2S)-2-(2,4-difluorophenyl)-1,3-thiazolidin-3-yl]ethanone
CID 7418795
3-[(3-fluorophenyl)methyl]-2-(2,3,4-trifluorophenyl)-1,3-thiazolidin-4-one
CID 3858526
2-(2-fluorophenyl)-3-(2-hydroxypropyl)-1,3-thiazolidin-4-one
CID 24712043
3-[(4-fluorophenyl)methyl]-2-(2-methylphenyl)-1,3-thiazolidin-4-one
CID 3387425

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide?
The IUPAC name of 2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide (CID 24712216) is 2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide.
What is the SMILES notation for 2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide?
The canonical SMILES for 2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide is CNC(=O)CN1C(=O)CSC1c1ccc(F)cc1F.
What is the InChIKey of 2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide?
The InChIKey is RZSVFRHSWZYWLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F2N2O2S/c1-15-10(17)5-16-11(18)6-19-12(16)8-3-2-7(13)4-9(8)14/h2-4,12H,5-6H2,1H3,(H,15,17).
What are the key properties of 2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide?
2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide has a molecular weight of 286.30 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,4-difluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-methylacetamide is sourced from PubChem (CID 24712216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).