trimethyl(1-triethoxysilylpropyl)azanium

C12H30NO3Si+ — CID 3020209

IUPACtrimethyl(1-triethoxysilylpropyl)azanium
SMILESCCO[Si](OCC)(OCC)C(CC)[N+](C)(C)C
InChIInChI=1S/C12H30NO3Si/c1-8-12(13(5,6)7)17(14-9-2,15-10-3)16-11-4/h12H,8-11H2,1-7H3/q+1
InChIKeyZTVTWFRZWHITPR-UHFFFAOYSA-N
MW264.46 g/mol
LogP2.06
Rot. Bonds9

About trimethyl(1-triethoxysilylpropyl)azanium

trimethyl(1-triethoxysilylpropyl)azanium (PubChem CID 3020209) has the molecular formula C12H30NO3Si+ and a molecular weight of 264.46 g/mol. Its IUPAC name is trimethyl(1-triethoxysilylpropyl)azanium.

Molecular Properties

Compound Nametrimethyl(1-triethoxysilylpropyl)azanium
PubChem CID3020209
Molecular FormulaC12H30NO3Si+
Molecular Weight264.46 g/mol
Exact Mass264.20
IUPAC Nametrimethyl(1-triethoxysilylpropyl)azanium
SMILESCCO[Si](OCC)(OCC)C(CC)[N+](C)(C)C
InChIInChI=1S/C12H30NO3Si/c1-8-12(13(5,6)7)17(14-9-2,15-10-3)16-11-4/h12H,8-11H2,1-7H3/q+1
InChIKeyZTVTWFRZWHITPR-UHFFFAOYSA-N
XLogP2.06
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-Propanamine, N,N-dimethyl-3-(trimethoxysilyl)-
CID 75668
1-Propanamine, N,N-diethyl-3-(trimethoxysilyl)-
CID 170458
Ethanamine, N-ethyl-N-((triethoxysilyl)methyl)-
CID 203781
Trimethoxysilylpropyl-N,N,N-trimethylammonium chloride
CID 94462
N-Butyl-N-((triethoxysilyl)methyl)butan-1-amine
CID 186203
Triethoxysilylpropyltrimethylammonium chloride
CID 23002981
(3-N,N-Dimethylaminopropyl)methyldimethoxysilane
CID 12495938
N,N,N-trimethyl-3-(trimethoxysilyl)propan-1-aminium
CID 94463
1-Butanamine, N-butyl-N-((ethoxydimethylsilyl)methyl)-
CID 189993
N,N-Dimethyl-3-(triethoxysilyl)propan-1-amine
CID 13574941
N,N-Diethyl-3-(triethoxysilyl)propan-1-amine
CID 15001037
1-Propanamine, N,N-dimethyl-3-(trimethoxysilyl)-, hydrochloride (1:1)
CID 105544

Frequently Asked Questions

What is the IUPAC name of trimethyl(1-triethoxysilylpropyl)azanium?
The IUPAC name of trimethyl(1-triethoxysilylpropyl)azanium (CID 3020209) is trimethyl(1-triethoxysilylpropyl)azanium.
What is the SMILES notation for trimethyl(1-triethoxysilylpropyl)azanium?
The canonical SMILES for trimethyl(1-triethoxysilylpropyl)azanium is CCO[Si](OCC)(OCC)C(CC)[N+](C)(C)C.
What is the InChIKey of trimethyl(1-triethoxysilylpropyl)azanium?
The InChIKey is ZTVTWFRZWHITPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H30NO3Si/c1-8-12(13(5,6)7)17(14-9-2,15-10-3)16-11-4/h12H,8-11H2,1-7H3/q+1.
What are the key properties of trimethyl(1-triethoxysilylpropyl)azanium?
trimethyl(1-triethoxysilylpropyl)azanium has a molecular weight of 264.46 g/mol, XLogP of 2.06, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(1-triethoxysilylpropyl)azanium is sourced from PubChem (CID 3020209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).