2-trimethylsilylethanesulfonamide

C5H15NO2SSi — CID 11008553

IUPAC2-trimethylsilylethanesulfonamide
SMILESC[Si](C)(C)CCS(N)(=O)=O
InChIInChI=1S/C5H15NO2SSi/c1-10(2,3)5-4-9(6,7)8/h4-5H2,1-3H3,(H2,6,7,8)
InChIKeyMZASHBBAFBWNFL-UHFFFAOYSA-N
MW181.33 g/mol
LogP0.61
Rot. Bonds3

About 2-trimethylsilylethanesulfonamide

2-trimethylsilylethanesulfonamide (PubChem CID 11008553) has the molecular formula C5H15NO2SSi and a molecular weight of 181.33 g/mol. Its IUPAC name is 2-trimethylsilylethanesulfonamide.

Molecular Properties

Compound Name2-trimethylsilylethanesulfonamide
PubChem CID11008553
Molecular FormulaC5H15NO2SSi
Molecular Weight181.33 g/mol
Exact Mass181.06
IUPAC Name2-trimethylsilylethanesulfonamide
SMILESC[Si](C)(C)CCS(N)(=O)=O
InChIInChI=1S/C5H15NO2SSi/c1-10(2,3)5-4-9(6,7)8/h4-5H2,1-3H3,(H2,6,7,8)
InChIKeyMZASHBBAFBWNFL-UHFFFAOYSA-N
XLogP0.61
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.33
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-trimethylsilylethanesulfonamide 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 2-trimethylsilylethanesulfonamide?
The IUPAC name of 2-trimethylsilylethanesulfonamide (CID 11008553) is 2-trimethylsilylethanesulfonamide.
What is the SMILES notation for 2-trimethylsilylethanesulfonamide?
The canonical SMILES for 2-trimethylsilylethanesulfonamide is C[Si](C)(C)CCS(N)(=O)=O.
What is the InChIKey of 2-trimethylsilylethanesulfonamide?
The InChIKey is MZASHBBAFBWNFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H15NO2SSi/c1-10(2,3)5-4-9(6,7)8/h4-5H2,1-3H3,(H2,6,7,8).
What are the key properties of 2-trimethylsilylethanesulfonamide?
2-trimethylsilylethanesulfonamide has a molecular weight of 181.33 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-trimethylsilylethanesulfonamide is sourced from PubChem (CID 11008553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).