N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide

C13H14N2O3S — CID 31512402

IUPACN-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCC(=O)c1ccccc1NC(=O)CN1CSCC1=O
InChIInChI=1S/C13H14N2O3S/c1-9(16)10-4-2-3-5-11(10)14-12(17)6-15-8-19-7-13(15)18/h2-5H,6-8H2,1H3,(H,14,17)
InChIKeyLIYFLEDEAHTFGM-UHFFFAOYSA-N
MW278.33 g/mol
LogP1.36
Rot. Bonds4

About N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide

N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 31512402) has the molecular formula C13H14N2O3S and a molecular weight of 278.33 g/mol. Its IUPAC name is N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID31512402
Molecular FormulaC13H14N2O3S
Molecular Weight278.33 g/mol
Exact Mass278.07
IUPAC NameN-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCC(=O)c1ccccc1NC(=O)CN1CSCC1=O
InChIInChI=1S/C13H14N2O3S/c1-9(16)10-4-2-3-5-11(10)14-12(17)6-15-8-19-7-13(15)18/h2-5H,6-8H2,1H3,(H,14,17)
InChIKeyLIYFLEDEAHTFGM-UHFFFAOYSA-N
XLogP1.36
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-oxo-1,3-thiazolidin-3-yl)-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 33372160
N-(2-chloro-4,5-dimethoxyphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 18139959
N-(1H-indazol-7-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 34201906
N-(2-acetylphenyl)-2-(3,4-dihydroxypyrrolidin-1-yl)acetamide
CID 106672145
1-[2-(2-acetylanilino)-2-oxoethyl]piperidine-4-carboxylic acid;hydrochloride
CID 119906608
N-(2-acetylphenyl)-2-(4-benzylpiperazin-1-yl)acetamide
CID 8902773
4-methoxy-3-[[2-(4-oxo-1,3-thiazolidin-3-yl)acetyl]amino]benzoic acid
CID 63744787
N-(5-chloro-2-methoxyphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 26094914
N-(2-acetylphenyl)-2-[4-(2-thiophen-2-ylethyl)piperazin-1-yl]acetamide
CID 47073375
N-[2-(2,3-dimethylphenoxy)-3-pyridinyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 94629453
2-[[2-(2-oxo-1,3-thiazolidin-3-yl)acetyl]amino]benzamide
CID 47118630
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 8834284

Frequently Asked Questions

What is the IUPAC name of N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 31512402) is N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is CC(=O)c1ccccc1NC(=O)CN1CSCC1=O.
What is the InChIKey of N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is LIYFLEDEAHTFGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S/c1-9(16)10-4-2-3-5-11(10)14-12(17)6-15-8-19-7-13(15)18/h2-5H,6-8H2,1H3,(H,14,17).
What are the key properties of N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 278.33 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 31512402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).