2-(2-methylcyclopropen-1-yl)sulfanylacetamide

C6H9NOS — CID 123185231

IUPAC2-(2-methylcyclopropen-1-yl)sulfanylacetamide
SMILESCC1=C(SCC(N)=O)C1
InChIInChI=1S/C6H9NOS/c1-4-2-5(4)9-3-6(7)8/h2-3H2,1H3,(H2,7,8)
InChIKeyVGDBHWIIQLFDDC-UHFFFAOYSA-N
MW143.21 g/mol
LogP0.88
Rot. Bonds3

About 2-(2-methylcyclopropen-1-yl)sulfanylacetamide

2-(2-methylcyclopropen-1-yl)sulfanylacetamide (PubChem CID 123185231) has the molecular formula C6H9NOS and a molecular weight of 143.21 g/mol. Its IUPAC name is 2-(2-methylcyclopropen-1-yl)sulfanylacetamide.

Molecular Properties

Compound Name2-(2-methylcyclopropen-1-yl)sulfanylacetamide
PubChem CID123185231
Molecular FormulaC6H9NOS
Molecular Weight143.21 g/mol
Exact Mass143.04
IUPAC Name2-(2-methylcyclopropen-1-yl)sulfanylacetamide
SMILESCC1=C(SCC(N)=O)C1
InChIInChI=1S/C6H9NOS/c1-4-2-5(4)9-3-6(7)8/h2-3H2,1H3,(H2,7,8)
InChIKeyVGDBHWIIQLFDDC-UHFFFAOYSA-N
XLogP0.88
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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2-(2-amino-5-methylphenyl)sulfanylacetamide
CID 79142056
3-(2-amino-2-oxoethyl)sulfanylbenzamide;ethane
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2-[[5-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide
CID 30399832
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CID 5108277
S-(2-amino-2-oxoethyl) methanethioate
CID 89207904
4-(2-amino-2-oxoethyl)sulfanyl-2-cyclopropyl-6-methylpyrimidine-5-carboxylic acid
CID 43395879
2-[6-(4-methoxyphenyl)pyridazin-3-yl]sulfanylacetamide
CID 3227985
2-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
CID 864878
2-(6,7-dimethoxy-3-methylquinolin-2-yl)sulfanylacetamide
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2-(8-methoxydibenzofuran-2-yl)sulfanylacetamide
CID 11536559

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylcyclopropen-1-yl)sulfanylacetamide?
The IUPAC name of 2-(2-methylcyclopropen-1-yl)sulfanylacetamide (CID 123185231) is 2-(2-methylcyclopropen-1-yl)sulfanylacetamide.
What is the SMILES notation for 2-(2-methylcyclopropen-1-yl)sulfanylacetamide?
The canonical SMILES for 2-(2-methylcyclopropen-1-yl)sulfanylacetamide is CC1=C(SCC(N)=O)C1.
What is the InChIKey of 2-(2-methylcyclopropen-1-yl)sulfanylacetamide?
The InChIKey is VGDBHWIIQLFDDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NOS/c1-4-2-5(4)9-3-6(7)8/h2-3H2,1H3,(H2,7,8).
What are the key properties of 2-(2-methylcyclopropen-1-yl)sulfanylacetamide?
2-(2-methylcyclopropen-1-yl)sulfanylacetamide has a molecular weight of 143.21 g/mol, XLogP of 0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylcyclopropen-1-yl)sulfanylacetamide is sourced from PubChem (CID 123185231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).