1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane

C9H26N2O3SSi2 — CID 23130195

IUPAC1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane
SMILESC[Si](C)(C)C(N(CCO)S(N)(=O)=O)[Si](C)(C)C
InChIInChI=1S/C9H26N2O3SSi2/c1-16(2,3)9(17(4,5)6)11(7-8-12)15(10,13)14/h9,12H,7-8H2,1-6H3,(H2,10,13,14)
InChIKeyZBSZGOYVJBJXTQ-UHFFFAOYSA-N
MW298.56 g/mol
LogP0.61
Rot. Bonds6

About 1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane

1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane (PubChem CID 23130195) has the molecular formula C9H26N2O3SSi2 and a molecular weight of 298.56 g/mol. Its IUPAC name is 1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane.

Molecular Properties

Compound Name1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane
PubChem CID23130195
Molecular FormulaC9H26N2O3SSi2
Molecular Weight298.56 g/mol
Exact Mass298.12
IUPAC Name1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane
SMILESC[Si](C)(C)C(N(CCO)S(N)(=O)=O)[Si](C)(C)C
InChIInChI=1S/C9H26N2O3SSi2/c1-16(2,3)9(17(4,5)6)11(7-8-12)15(10,13)14/h9,12H,7-8H2,1-6H3,(H2,10,13,14)
InChIKeyZBSZGOYVJBJXTQ-UHFFFAOYSA-N
XLogP0.61
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.56
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane?
The IUPAC name of 1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane (CID 23130195) is 1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane.
What is the SMILES notation for 1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane?
The canonical SMILES for 1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane is C[Si](C)(C)C(N(CCO)S(N)(=O)=O)[Si](C)(C)C.
What is the InChIKey of 1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane?
The InChIKey is ZBSZGOYVJBJXTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H26N2O3SSi2/c1-16(2,3)9(17(4,5)6)11(7-8-12)15(10,13)14/h9,12H,7-8H2,1-6H3,(H2,10,13,14).
What are the key properties of 1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane?
1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane has a molecular weight of 298.56 g/mol, XLogP of 0.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[bis(trimethylsilyl)methyl-sulfamoylamino]-2-hydroxyethane is sourced from PubChem (CID 23130195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).