2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide

C7H12N2O3S — CID 21303104

IUPAC2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide
SMILESCC1SC(CC(=O)NO)C(=O)N1C
InChIInChI=1S/C7H12N2O3S/c1-4-9(2)7(11)5(13-4)3-6(10)8-12/h4-5,12H,3H2,1-2H3,(H,8,10)
InChIKeyBIKDJNITDKCCIT-UHFFFAOYSA-N
MW204.25 g/mol
LogP-0.20
Rot. Bonds2

About 2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide

2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide (PubChem CID 21303104) has the molecular formula C7H12N2O3S and a molecular weight of 204.25 g/mol. Its IUPAC name is 2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide.

Molecular Properties

Compound Name2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide
PubChem CID21303104
Molecular FormulaC7H12N2O3S
Molecular Weight204.25 g/mol
Exact Mass204.06
IUPAC Name2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide
SMILESCC1SC(CC(=O)NO)C(=O)N1C
InChIInChI=1S/C7H12N2O3S/c1-4-9(2)7(11)5(13-4)3-6(10)8-12/h4-5,12H,3H2,1-2H3,(H,8,10)
InChIKeyBIKDJNITDKCCIT-UHFFFAOYSA-N
XLogP-0.20
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.25
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[(2-Aminoethyl)sulfanyl]-1-ethylpyrrolidine-2,5-dione
CID 43638417
2-[5-[2-(dimethylamino)-2-oxoethyl]-2-methyl-4-oxo-1,3-thiazolidin-3-yl]-N-hydroxypropanamide
CID 21303108
3-(2-Aminoethylsulfanyl)-1-methylpyrrolidine-2,5-dione
CID 43638415
2-(3-Methyl-2,4-dioxo-1,3-thiazolidin-5-yl)acetamide
CID 87738650
3-(1-Aminoethylsulfanyl)-1-methylpyrrolidine-2,5-dione
CID 134402694
3-(1-Methyl-2,5-dioxopyrrolidin-3-yl)sulfanylpropanamide
CID 172155250
3-(2-Aminoethylsulfanyl)-1-methylpyrrolidin-2-one
CID 64264824
3-(1-Aminopropan-2-ylsulfanyl)-1-methylpyrrolidine-2,5-dione
CID 66218134
3-(3-Aminopropylsulfanyl)-1-methylpyrrolidine-2,5-dione
CID 66219805
5-(2-Aminoethyl)-3-ethyl-1,3-thiazolidine-2,4-dione
CID 82504482
(3S)-3-(2-aminoethylsulfanyl)-1-ethylpyrrolidine-2,5-dione
CID 93253832
(3R)-3-(2-aminoethylsulfanyl)-1-ethylpyrrolidine-2,5-dione
CID 98341231

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide?
The IUPAC name of 2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide (CID 21303104) is 2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide.
What is the SMILES notation for 2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide?
The canonical SMILES for 2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide is CC1SC(CC(=O)NO)C(=O)N1C.
What is the InChIKey of 2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide?
The InChIKey is BIKDJNITDKCCIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O3S/c1-4-9(2)7(11)5(13-4)3-6(10)8-12/h4-5,12H,3H2,1-2H3,(H,8,10).
What are the key properties of 2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide?
2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide has a molecular weight of 204.25 g/mol, XLogP of -0.20, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethyl-4-oxo-1,3-thiazolidin-5-yl)-N-hydroxyacetamide is sourced from PubChem (CID 21303104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).