2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate

C9H21NO4SSi — CID 23564131

IUPAC2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate
SMILESCCNS(=O)(=O)CC(=O)OCC[Si](C)(C)C
InChIInChI=1S/C9H21NO4SSi/c1-5-10-15(12,13)8-9(11)14-6-7-16(2,3)4/h10H,5-8H2,1-4H3
InChIKeyUXAASYAWOZQHQQ-UHFFFAOYSA-N
MW267.42 g/mol
LogP0.81
Rot. Bonds7

About 2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate

2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate (PubChem CID 23564131) has the molecular formula C9H21NO4SSi and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate.

Molecular Properties

Compound Name2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate
PubChem CID23564131
Molecular FormulaC9H21NO4SSi
Molecular Weight267.42 g/mol
Exact Mass267.10
IUPAC Name2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate
SMILESCCNS(=O)(=O)CC(=O)OCC[Si](C)(C)C
InChIInChI=1S/C9H21NO4SSi/c1-5-10-15(12,13)8-9(11)14-6-7-16(2,3)4/h10H,5-8H2,1-4H3
InChIKeyUXAASYAWOZQHQQ-UHFFFAOYSA-N
XLogP0.81
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate?
The IUPAC name of 2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate (CID 23564131) is 2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate.
What is the SMILES notation for 2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate?
The canonical SMILES for 2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate is CCNS(=O)(=O)CC(=O)OCC[Si](C)(C)C.
What is the InChIKey of 2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate?
The InChIKey is UXAASYAWOZQHQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO4SSi/c1-5-10-15(12,13)8-9(11)14-6-7-16(2,3)4/h10H,5-8H2,1-4H3.
What are the key properties of 2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate?
2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate has a molecular weight of 267.42 g/mol, XLogP of 0.81, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-trimethylsilylethyl 2-(ethylsulfamoyl)acetate is sourced from PubChem (CID 23564131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).