oxiran-2-ylmethyl N-silylcarbamate

C4H9NO3Si — CID 173486897

IUPACoxiran-2-ylmethyl N-silylcarbamate
SMILESO=C(N[SiH3])OCC1CO1
InChIInChI=1S/C4H9NO3Si/c6-4(5-9)8-2-3-1-7-3/h3H,1-2H2,9H3,(H,5,6)
InChIKeyTUPURZDKHISQJZ-UHFFFAOYSA-N
MW147.21 g/mol
LogP-1.61
Rot. Bonds2

About oxiran-2-ylmethyl N-silylcarbamate

oxiran-2-ylmethyl N-silylcarbamate (PubChem CID 173486897) has the molecular formula C4H9NO3Si and a molecular weight of 147.21 g/mol. Its IUPAC name is oxiran-2-ylmethyl N-silylcarbamate.

Molecular Properties

Compound Nameoxiran-2-ylmethyl N-silylcarbamate
PubChem CID173486897
Molecular FormulaC4H9NO3Si
Molecular Weight147.21 g/mol
Exact Mass147.04
IUPAC Nameoxiran-2-ylmethyl N-silylcarbamate
SMILESO=C(N[SiH3])OCC1CO1
InChIInChI=1S/C4H9NO3Si/c6-4(5-9)8-2-3-1-7-3/h3H,1-2H2,9H3,(H,5,6)
InChIKeyTUPURZDKHISQJZ-UHFFFAOYSA-N
XLogP-1.61
TPSA50.86 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.21
LogP ≤ 5-1.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of oxiran-2-ylmethyl N-silylcarbamate?
The IUPAC name of oxiran-2-ylmethyl N-silylcarbamate (CID 173486897) is oxiran-2-ylmethyl N-silylcarbamate.
What is the SMILES notation for oxiran-2-ylmethyl N-silylcarbamate?
The canonical SMILES for oxiran-2-ylmethyl N-silylcarbamate is O=C(N[SiH3])OCC1CO1.
What is the InChIKey of oxiran-2-ylmethyl N-silylcarbamate?
The InChIKey is TUPURZDKHISQJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO3Si/c6-4(5-9)8-2-3-1-7-3/h3H,1-2H2,9H3,(H,5,6).
What are the key properties of oxiran-2-ylmethyl N-silylcarbamate?
oxiran-2-ylmethyl N-silylcarbamate has a molecular weight of 147.21 g/mol, XLogP of -1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxiran-2-ylmethyl N-silylcarbamate is sourced from PubChem (CID 173486897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).