dimethoxy(methyl)silane;methylimino(oxo)methane

C5H13NO3Si — CID 159174466

IUPACdimethoxy(methyl)silane;methylimino(oxo)methane
SMILESCN=C=O.CO[SiH](C)OC
InChIInChI=1S/C3H10O2Si.C2H3NO/c1-4-6(3)5-2;1-3-2-4/h6H,1-3H3;1H3
InChIKeyKMCIBZNYNRTIGS-UHFFFAOYSA-N
MW163.25 g/mol
LogP0.08
Rot. Bonds2

About dimethoxy(methyl)silane;methylimino(oxo)methane

dimethoxy(methyl)silane;methylimino(oxo)methane (PubChem CID 159174466) has the molecular formula C5H13NO3Si and a molecular weight of 163.25 g/mol. Its IUPAC name is dimethoxy(methyl)silane;methylimino(oxo)methane.

Molecular Properties

Compound Namedimethoxy(methyl)silane;methylimino(oxo)methane
PubChem CID159174466
Molecular FormulaC5H13NO3Si
Molecular Weight163.25 g/mol
Exact Mass163.07
IUPAC Namedimethoxy(methyl)silane;methylimino(oxo)methane
SMILESCN=C=O.CO[SiH](C)OC
InChIInChI=1S/C3H10O2Si.C2H3NO/c1-4-6(3)5-2;1-3-2-4/h6H,1-3H3;1H3
InChIKeyKMCIBZNYNRTIGS-UHFFFAOYSA-N
XLogP0.08
TPSA47.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.25
LogP ≤ 50.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isocyanate', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dimethoxy(methyl)silane;methylimino(oxo)methane?
The IUPAC name of dimethoxy(methyl)silane;methylimino(oxo)methane (CID 159174466) is dimethoxy(methyl)silane;methylimino(oxo)methane.
What is the SMILES notation for dimethoxy(methyl)silane;methylimino(oxo)methane?
The canonical SMILES for dimethoxy(methyl)silane;methylimino(oxo)methane is CN=C=O.CO[SiH](C)OC.
What is the InChIKey of dimethoxy(methyl)silane;methylimino(oxo)methane?
The InChIKey is KMCIBZNYNRTIGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10O2Si.C2H3NO/c1-4-6(3)5-2;1-3-2-4/h6H,1-3H3;1H3.
What are the key properties of dimethoxy(methyl)silane;methylimino(oxo)methane?
dimethoxy(methyl)silane;methylimino(oxo)methane has a molecular weight of 163.25 g/mol, XLogP of 0.08, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy(methyl)silane;methylimino(oxo)methane is sourced from PubChem (CID 159174466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).