1-(2-methylsulfanylacetyl)imidazolidin-2-one

C6H10N2O2S — CID 130877596

IUPAC1-(2-methylsulfanylacetyl)imidazolidin-2-one
SMILESCSCC(=O)N1CCNC1=O
InChIInChI=1S/C6H10N2O2S/c1-11-4-5(9)8-3-2-7-6(8)10/h2-4H2,1H3,(H,7,10)
InChIKeyZEZXSPIWQBRANU-UHFFFAOYSA-N
MW174.22 g/mol
LogP-0.10
Rot. Bonds2

About 1-(2-methylsulfanylacetyl)imidazolidin-2-one

1-(2-methylsulfanylacetyl)imidazolidin-2-one (PubChem CID 130877596) has the molecular formula C6H10N2O2S and a molecular weight of 174.22 g/mol. Its IUPAC name is 1-(2-methylsulfanylacetyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(2-methylsulfanylacetyl)imidazolidin-2-one
PubChem CID130877596
Molecular FormulaC6H10N2O2S
Molecular Weight174.22 g/mol
Exact Mass174.05
IUPAC Name1-(2-methylsulfanylacetyl)imidazolidin-2-one
SMILESCSCC(=O)N1CCNC1=O
InChIInChI=1S/C6H10N2O2S/c1-11-4-5(9)8-3-2-7-6(8)10/h2-4H2,1H3,(H,7,10)
InChIKeyZEZXSPIWQBRANU-UHFFFAOYSA-N
XLogP-0.10
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.22
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylsulfanylacetyl)imidazolidin-2-one?
The IUPAC name of 1-(2-methylsulfanylacetyl)imidazolidin-2-one (CID 130877596) is 1-(2-methylsulfanylacetyl)imidazolidin-2-one.
What is the SMILES notation for 1-(2-methylsulfanylacetyl)imidazolidin-2-one?
The canonical SMILES for 1-(2-methylsulfanylacetyl)imidazolidin-2-one is CSCC(=O)N1CCNC1=O.
What is the InChIKey of 1-(2-methylsulfanylacetyl)imidazolidin-2-one?
The InChIKey is ZEZXSPIWQBRANU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2S/c1-11-4-5(9)8-3-2-7-6(8)10/h2-4H2,1H3,(H,7,10).
What are the key properties of 1-(2-methylsulfanylacetyl)imidazolidin-2-one?
1-(2-methylsulfanylacetyl)imidazolidin-2-one has a molecular weight of 174.22 g/mol, XLogP of -0.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylsulfanylacetyl)imidazolidin-2-one is sourced from PubChem (CID 130877596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).