5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione

C6H10N2O2S — CID 22152154

IUPAC5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione
SMILESCC(S)N1C(=O)NC(=O)C1C
InChIInChI=1S/C6H10N2O2S/c1-3-5(9)7-6(10)8(3)4(2)11/h3-4,11H,1-2H3,(H,7,9,10)
InChIKeyMWCUFUQAROBLRB-UHFFFAOYSA-N
MW174.22 g/mol
LogP0.20
Rot. Bonds1

About 5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione

5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione (PubChem CID 22152154) has the molecular formula C6H10N2O2S and a molecular weight of 174.22 g/mol. Its IUPAC name is 5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione
PubChem CID22152154
Molecular FormulaC6H10N2O2S
Molecular Weight174.22 g/mol
Exact Mass174.05
IUPAC Name5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione
SMILESCC(S)N1C(=O)NC(=O)C1C
InChIInChI=1S/C6H10N2O2S/c1-3-5(9)7-6(10)8(3)4(2)11/h3-4,11H,1-2H3,(H,7,9,10)
InChIKeyMWCUFUQAROBLRB-UHFFFAOYSA-N
XLogP0.20
TPSA49.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.22
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione?
The IUPAC name of 5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione (CID 22152154) is 5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione is CC(S)N1C(=O)NC(=O)C1C.
What is the InChIKey of 5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione?
The InChIKey is MWCUFUQAROBLRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2S/c1-3-5(9)7-6(10)8(3)4(2)11/h3-4,11H,1-2H3,(H,7,9,10).
What are the key properties of 5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione?
5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione has a molecular weight of 174.22 g/mol, XLogP of 0.20, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-(1-sulfanylethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 22152154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).