2,2-dimethoxy-5-methylazasilinane

C7H17NO2Si — CID 57044830

IUPAC2,2-dimethoxy-5-methylazasilinane
SMILESCO[Si]1(OC)CCC(C)CN1
InChIInChI=1S/C7H17NO2Si/c1-7-4-5-11(9-2,10-3)8-6-7/h7-8H,4-6H2,1-3H3
InChIKeyMCCDDROROGGTII-UHFFFAOYSA-N
MW175.30 g/mol
LogP0.85
Rot. Bonds2

About 2,2-dimethoxy-5-methylazasilinane

2,2-dimethoxy-5-methylazasilinane (PubChem CID 57044830) has the molecular formula C7H17NO2Si and a molecular weight of 175.30 g/mol. Its IUPAC name is 2,2-dimethoxy-5-methylazasilinane.

Molecular Properties

Compound Name2,2-dimethoxy-5-methylazasilinane
PubChem CID57044830
Molecular FormulaC7H17NO2Si
Molecular Weight175.30 g/mol
Exact Mass175.10
IUPAC Name2,2-dimethoxy-5-methylazasilinane
SMILESCO[Si]1(OC)CCC(C)CN1
InChIInChI=1S/C7H17NO2Si/c1-7-4-5-11(9-2,10-3)8-6-7/h7-8H,4-6H2,1-3H3
InChIKeyMCCDDROROGGTII-UHFFFAOYSA-N
XLogP0.85
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.30
LogP ≤ 50.85
H-Bond Donors ≤ 51
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 2,2-dimethoxy-5-methylazasilinane?
The IUPAC name of 2,2-dimethoxy-5-methylazasilinane (CID 57044830) is 2,2-dimethoxy-5-methylazasilinane.
What is the SMILES notation for 2,2-dimethoxy-5-methylazasilinane?
The canonical SMILES for 2,2-dimethoxy-5-methylazasilinane is CO[Si]1(OC)CCC(C)CN1.
What is the InChIKey of 2,2-dimethoxy-5-methylazasilinane?
The InChIKey is MCCDDROROGGTII-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO2Si/c1-7-4-5-11(9-2,10-3)8-6-7/h7-8H,4-6H2,1-3H3.
What are the key properties of 2,2-dimethoxy-5-methylazasilinane?
2,2-dimethoxy-5-methylazasilinane has a molecular weight of 175.30 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethoxy-5-methylazasilinane is sourced from PubChem (CID 57044830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).