3-[dimethoxy(methyl)silyl]propyl-trimethylazanium

C9H24NO2Si+ — CID 13141498

IUPAC3-[dimethoxy(methyl)silyl]propyl-trimethylazanium
SMILESCO[Si](C)(CCC[N+](C)(C)C)OC
InChIInChI=1S/C9H24NO2Si/c1-10(2,3)8-7-9-13(6,11-4)12-5/h7-9H2,1-6H3/q+1
InChIKeyIFMLZJWKHPENFT-UHFFFAOYSA-N
MW206.38 g/mol
LogP1.45
Rot. Bonds6

About 3-[dimethoxy(methyl)silyl]propyl-trimethylazanium

3-[dimethoxy(methyl)silyl]propyl-trimethylazanium (PubChem CID 13141498) has the molecular formula C9H24NO2Si+ and a molecular weight of 206.38 g/mol. Its IUPAC name is 3-[dimethoxy(methyl)silyl]propyl-trimethylazanium.

Molecular Properties

Compound Name3-[dimethoxy(methyl)silyl]propyl-trimethylazanium
PubChem CID13141498
Molecular FormulaC9H24NO2Si+
Molecular Weight206.38 g/mol
Exact Mass206.16
IUPAC Name3-[dimethoxy(methyl)silyl]propyl-trimethylazanium
SMILESCO[Si](C)(CCC[N+](C)(C)C)OC
InChIInChI=1S/C9H24NO2Si/c1-10(2,3)8-7-9-13(6,11-4)12-5/h7-9H2,1-6H3/q+1
InChIKeyIFMLZJWKHPENFT-UHFFFAOYSA-N
XLogP1.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.38
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[dimethoxy(methyl)silyl]propyl-trimethylazanium?
The IUPAC name of 3-[dimethoxy(methyl)silyl]propyl-trimethylazanium (CID 13141498) is 3-[dimethoxy(methyl)silyl]propyl-trimethylazanium.
What is the SMILES notation for 3-[dimethoxy(methyl)silyl]propyl-trimethylazanium?
The canonical SMILES for 3-[dimethoxy(methyl)silyl]propyl-trimethylazanium is CO[Si](C)(CCC[N+](C)(C)C)OC.
What is the InChIKey of 3-[dimethoxy(methyl)silyl]propyl-trimethylazanium?
The InChIKey is IFMLZJWKHPENFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H24NO2Si/c1-10(2,3)8-7-9-13(6,11-4)12-5/h7-9H2,1-6H3/q+1.
What are the key properties of 3-[dimethoxy(methyl)silyl]propyl-trimethylazanium?
3-[dimethoxy(methyl)silyl]propyl-trimethylazanium has a molecular weight of 206.38 g/mol, XLogP of 1.45, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dimethoxy(methyl)silyl]propyl-trimethylazanium is sourced from PubChem (CID 13141498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).