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

C5H8N2O4S — CID 59794401

IUPAC(5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione
SMILESCS(=O)(=O)C[C@H]1NC(=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)/t3-/m1/s1
InChIKeySVENCWCBHOXCHT-GSVOUGTGSA-N
MW192.20 g/mol
LogP-1.76
Rot. Bonds2

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

(5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione (PubChem CID 59794401) has the molecular formula C5H8N2O4S and a molecular weight of 192.20 g/mol. Its IUPAC name is (5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione
PubChem CID59794401
Molecular FormulaC5H8N2O4S
Molecular Weight192.20 g/mol
Exact Mass192.02
IUPAC Name(5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione
SMILESCS(=O)(=O)C[C@H]1NC(=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)/t3-/m1/s1
InChIKeySVENCWCBHOXCHT-GSVOUGTGSA-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'}

Analyze (5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione?
The IUPAC name of (5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione (CID 59794401) is (5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione?
The canonical SMILES for (5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione is CS(=O)(=O)C[C@H]1NC(=O)NC1=O.
What is the InChIKey of (5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione?
The InChIKey is SVENCWCBHOXCHT-GSVOUGTGSA-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)/t3-/m1/s1.
What are the key properties of (5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione?
(5S)-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 (5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 59794401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).