5-(methylsulfonylmethyl)imidazolidine-2,4-dione

C5H8N2O4S — CID 59862570

IUPAC5-(methylsulfonylmethyl)imidazolidine-2,4-dione
SMILESCS(=O)(=O)CC1NC(=O)NC1=O
InChIInChI=1S/C5H8N2O4S/c1-12(10,11)2-3-4(8)7-5(9)6-3/h3H,2H2,1H3,(H2,6,7,8,9)
InChIKeySVENCWCBHOXCHT-UHFFFAOYSA-N
MW192.20 g/mol
LogP-1.76
Rot. Bonds2

About 5-(methylsulfonylmethyl)imidazolidine-2,4-dione

5-(methylsulfonylmethyl)imidazolidine-2,4-dione (PubChem CID 59862570) has the molecular formula C5H8N2O4S and a molecular weight of 192.20 g/mol. Its IUPAC name is 5-(methylsulfonylmethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(methylsulfonylmethyl)imidazolidine-2,4-dione
PubChem CID59862570
Molecular FormulaC5H8N2O4S
Molecular Weight192.20 g/mol
Exact Mass192.02
IUPAC Name5-(methylsulfonylmethyl)imidazolidine-2,4-dione
SMILESCS(=O)(=O)CC1NC(=O)NC1=O
InChIInChI=1S/C5H8N2O4S/c1-12(10,11)2-3-4(8)7-5(9)6-3/h3H,2H2,1H3,(H2,6,7,8,9)
InChIKeySVENCWCBHOXCHT-UHFFFAOYSA-N
XLogP-1.76
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.20
LogP ≤ 5-1.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(methylsulfonylmethyl)imidazolidine-2,4-dione?
The IUPAC name of 5-(methylsulfonylmethyl)imidazolidine-2,4-dione (CID 59862570) is 5-(methylsulfonylmethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-(methylsulfonylmethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-(methylsulfonylmethyl)imidazolidine-2,4-dione is CS(=O)(=O)CC1NC(=O)NC1=O.
What is the InChIKey of 5-(methylsulfonylmethyl)imidazolidine-2,4-dione?
The InChIKey is SVENCWCBHOXCHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O4S/c1-12(10,11)2-3-4(8)7-5(9)6-3/h3H,2H2,1H3,(H2,6,7,8,9).
What are the key properties of 5-(methylsulfonylmethyl)imidazolidine-2,4-dione?
5-(methylsulfonylmethyl)imidazolidine-2,4-dione has a molecular weight of 192.20 g/mol, XLogP of -1.76, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylsulfonylmethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 59862570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).