N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide

C10H14N2O3S2 — CID 110679622

IUPACN-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide
SMILESCc1ncsc1CC(=O)NC1CCS(=O)(=O)C1
InChIInChI=1S/C10H14N2O3S2/c1-7-9(16-6-11-7)4-10(13)12-8-2-3-17(14,15)5-8/h6,8H,2-5H2,1H3,(H,12,13)
InChIKeyOVEYGWQIONVDMG-UHFFFAOYSA-N
MW274.37 g/mol
LogP0.30
Rot. Bonds3

About N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide

N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide (PubChem CID 110679622) has the molecular formula C10H14N2O3S2 and a molecular weight of 274.37 g/mol. Its IUPAC name is N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide
PubChem CID110679622
Molecular FormulaC10H14N2O3S2
Molecular Weight274.37 g/mol
Exact Mass274.04
IUPAC NameN-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide
SMILESCc1ncsc1CC(=O)NC1CCS(=O)(=O)C1
InChIInChI=1S/C10H14N2O3S2/c1-7-9(16-6-11-7)4-10(13)12-8-2-3-17(14,15)5-8/h6,8H,2-5H2,1H3,(H,12,13)
InChIKeyOVEYGWQIONVDMG-UHFFFAOYSA-N
XLogP0.30
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-2-(4-methyl-1,3-thiazol-5-yl)acetamide
CID 110679572
N-[(3S)-1,1-dioxothiolan-3-yl]-2-iodoacetamide
CID 9196310
N-[(3S)-1,1-dioxothiolan-3-yl]-2-phenylacetamide
CID 40569648
2-(3,5-dimethylphenoxy)-N-[(3R)-1,1-dioxothiolan-3-yl]acetamide
CID 41099474
2-(3,5-dimethylpyrazol-1-yl)-N-(1,1-dioxothiolan-3-yl)acetamide
CID 45148400
N-[(3R)-1,1-dioxothiolan-3-yl]-2-[2-(methanesulfonamido)-1,3-thiazol-4-yl]acetamide
CID 41063797
N-(1,1-dioxothiolan-3-yl)-2-(4-methoxyphenyl)acetamide
CID 17013970
N-(1,1-dioxothiolan-3-yl)butanamide
CID 18573523
N-(1,1-dioxothiolan-3-yl)-2-(6-methylpyrimidin-4-yl)oxyacetamide
CID 110852790
2-(4,5-dimethoxy-2-methylphenyl)-N-(1,1-dioxothiolan-3-yl)acetamide
CID 110770066
[2-[[(3S)-1,1-dioxothiolan-3-yl]amino]-2-oxoethyl] 2,4-dimethyl-1,3-thiazole-5-carboxylate
CID 7954606
N-(1,1-dioxothiolan-3-yl)-6-methylimidazo[2,1-b][1,3,4]thiadiazole-5-carboxamide
CID 110852851

Frequently Asked Questions

What is the IUPAC name of N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide?
The IUPAC name of N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide (CID 110679622) is N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide.
What is the SMILES notation for N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide?
The canonical SMILES for N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide is Cc1ncsc1CC(=O)NC1CCS(=O)(=O)C1.
What is the InChIKey of N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide?
The InChIKey is OVEYGWQIONVDMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3S2/c1-7-9(16-6-11-7)4-10(13)12-8-2-3-17(14,15)5-8/h6,8H,2-5H2,1H3,(H,12,13).
What are the key properties of N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide?
N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide has a molecular weight of 274.37 g/mol, XLogP of 0.30, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,1-dioxothiolan-3-yl)-2-(4-methyl-1,3-thiazol-5-yl)acetamide is sourced from PubChem (CID 110679622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).