trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium

C9H24NO3Si+ — CID 174419403

IUPACtrimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium
SMILESCOC(C)(OC)C([SiH3])(OC)[N+](C)(C)C
InChIInChI=1S/C9H24NO3Si/c1-8(11-5,12-6)9(14,13-7)10(2,3)4/h1-7,14H3/q+1
InChIKeyNKZQYLVJHVMSFJ-UHFFFAOYSA-N
MW222.38 g/mol
LogP-0.63
Rot. Bonds5

About trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium

trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium (PubChem CID 174419403) has the molecular formula C9H24NO3Si+ and a molecular weight of 222.38 g/mol. Its IUPAC name is trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium.

Molecular Properties

Compound Nametrimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium
PubChem CID174419403
Molecular FormulaC9H24NO3Si+
Molecular Weight222.38 g/mol
Exact Mass222.15
IUPAC Nametrimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium
SMILESCOC(C)(OC)C([SiH3])(OC)[N+](C)(C)C
InChIInChI=1S/C9H24NO3Si/c1-8(11-5,12-6)9(14,13-7)10(2,3)4/h1-7,14H3/q+1
InChIKeyNKZQYLVJHVMSFJ-UHFFFAOYSA-N
XLogP-0.63
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 5-0.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

[1,2,2-trimethoxy-1-[4-(1,2,2-trimethoxy-1-silylpropyl)phenyl]propyl]silane
CID 174862070
(1,2,2-trimethoxy-1-pyrrol-1-ylpropyl)silane
CID 173236551
(3,3-dimethoxy-2-piperidin-3-ylbutan-2-yl)silane
CID 174882901
1,1,2,2-tetramethoxypropan-1-ol;titanium
CID 175425593
1,1,2-trimethoxy-1-silylpropane-2-thiol
CID 173183567
tert-butyl(trimethyl)azanium bromide
CID 23065042
2-methoxy-2-methylpropane;hydrate
CID 23212559
hydron;2-methoxy-2-methylpropane
CID 174107716
1,2,2-trimethoxy-N-prop-2-enyl-1-silylpropan-1-amine
CID 174425524
hydrazine;2-methoxy-2-methylpropane
CID 158568740
2,3-difluoro-2,3-dimethoxybutane
CID 174333179
1,1,1-trimethoxyethane;hydrochloride
CID 162313346

Frequently Asked Questions

What is the IUPAC name of trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium?
The IUPAC name of trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium (CID 174419403) is trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium.
What is the SMILES notation for trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium?
The canonical SMILES for trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium is COC(C)(OC)C([SiH3])(OC)[N+](C)(C)C.
What is the InChIKey of trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium?
The InChIKey is NKZQYLVJHVMSFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H24NO3Si/c1-8(11-5,12-6)9(14,13-7)10(2,3)4/h1-7,14H3/q+1.
What are the key properties of trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium?
trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium has a molecular weight of 222.38 g/mol, XLogP of -0.63, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(1,2,2-trimethoxy-1-silylpropyl)azanium is sourced from PubChem (CID 174419403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).