3-[methoxy(dipropyl)silyl]propyl-trimethylazanium

C13H32NOSi+ — CID 154408712

IUPAC3-[methoxy(dipropyl)silyl]propyl-trimethylazanium
SMILESCCC[Si](CCC)(CCC[N+](C)(C)C)OC
InChIInChI=1S/C13H32NOSi/c1-7-11-16(15-6,12-8-2)13-9-10-14(3,4)5/h7-13H2,1-6H3/q+1
InChIKeyBFIVIYWAGMRBIT-UHFFFAOYSA-N
MW246.49 g/mol
LogP3.49
Rot. Bonds9

About 3-[methoxy(dipropyl)silyl]propyl-trimethylazanium

3-[methoxy(dipropyl)silyl]propyl-trimethylazanium (PubChem CID 154408712) has the molecular formula C13H32NOSi+ and a molecular weight of 246.49 g/mol. Its IUPAC name is 3-[methoxy(dipropyl)silyl]propyl-trimethylazanium.

Molecular Properties

Compound Name3-[methoxy(dipropyl)silyl]propyl-trimethylazanium
PubChem CID154408712
Molecular FormulaC13H32NOSi+
Molecular Weight246.49 g/mol
Exact Mass246.22
IUPAC Name3-[methoxy(dipropyl)silyl]propyl-trimethylazanium
SMILESCCC[Si](CCC)(CCC[N+](C)(C)C)OC
InChIInChI=1S/C13H32NOSi/c1-7-11-16(15-6,12-8-2)13-9-10-14(3,4)5/h7-13H2,1-6H3/q+1
InChIKeyBFIVIYWAGMRBIT-UHFFFAOYSA-N
XLogP3.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.49
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

butyl-methoxy-dipropylsilane
CID 22228688
methoxy-[2-[methoxy(dipropyl)silyl]ethyl]-dipropylsilane
CID 87144124
3-chloropropyl-methoxy-dipropylsilane
CID 140744006
methanolate;bis(trimethyl(3-trimethoxysilylpropyl)azanium);chloride
CID 156778994
2-chloroethyl-methoxy-dipropylsilane
CID 171486072
dimethyl-octadecyl-(3-trimethoxysilylpropyl)azanium fluoride
CID 141427162
3-[dibutoxy(butyl)silyl]propyl-trimethylazanium
CID 154408709
butyl-dimethyl-(3-trimethoxysilylpropyl)azanium bromide
CID 177425552
hexadecyl(trimethyl)azanium;fluoride;dihydrofluoride
CID 173060050
trimethyl(3-trimethylsilylpropyl)azanium chloride
CID 87931852
diethyl-hexyl-methoxysilane
CID 59112330
butyl(trimethyl)azanium;methanol
CID 159541051

Frequently Asked Questions

What is the IUPAC name of 3-[methoxy(dipropyl)silyl]propyl-trimethylazanium?
The IUPAC name of 3-[methoxy(dipropyl)silyl]propyl-trimethylazanium (CID 154408712) is 3-[methoxy(dipropyl)silyl]propyl-trimethylazanium.
What is the SMILES notation for 3-[methoxy(dipropyl)silyl]propyl-trimethylazanium?
The canonical SMILES for 3-[methoxy(dipropyl)silyl]propyl-trimethylazanium is CCC[Si](CCC)(CCC[N+](C)(C)C)OC.
What is the InChIKey of 3-[methoxy(dipropyl)silyl]propyl-trimethylazanium?
The InChIKey is BFIVIYWAGMRBIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H32NOSi/c1-7-11-16(15-6,12-8-2)13-9-10-14(3,4)5/h7-13H2,1-6H3/q+1.
What are the key properties of 3-[methoxy(dipropyl)silyl]propyl-trimethylazanium?
3-[methoxy(dipropyl)silyl]propyl-trimethylazanium has a molecular weight of 246.49 g/mol, XLogP of 3.49, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methoxy(dipropyl)silyl]propyl-trimethylazanium is sourced from PubChem (CID 154408712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).