bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium

C19H54NO4Si6+ — CID 161237231

IUPACbis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium
SMILESCC[N+](C)(C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C)C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C19H54NO4Si6/c1-17-20(2,18-27(9,10)23-29(13,14)21-25(3,4)5)19-28(11,12)24-30(15,16)22-26(6,7)8/h17-19H2,1-16H3/q+1
InChIKeyUZNOUXVGONUCQV-UHFFFAOYSA-N
MW529.16 g/mol
LogP6.08
Rot. Bonds13

About bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium

bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium (PubChem CID 161237231) has the molecular formula C19H54NO4Si6+ and a molecular weight of 529.16 g/mol. Its IUPAC name is bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium.

Molecular Properties

Compound Namebis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium
PubChem CID161237231
Molecular FormulaC19H54NO4Si6+
Molecular Weight529.16 g/mol
Exact Mass528.27
IUPAC Namebis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium
SMILESCC[N+](C)(C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C)C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C19H54NO4Si6/c1-17-20(2,18-27(9,10)23-29(13,14)21-25(3,4)5)19-28(11,12)24-30(15,16)22-26(6,7)8/h17-19H2,1-16H3/q+1
InChIKeyUZNOUXVGONUCQV-UHFFFAOYSA-N
XLogP6.08
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms30
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500529.16
LogP ≤ 56.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium?
The IUPAC name of bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium (CID 161237231) is bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium.
What is the SMILES notation for bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium?
The canonical SMILES for bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium is CC[N+](C)(C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C)C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C.
What is the InChIKey of bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium?
The InChIKey is UZNOUXVGONUCQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H54NO4Si6/c1-17-20(2,18-27(9,10)23-29(13,14)21-25(3,4)5)19-28(11,12)24-30(15,16)22-26(6,7)8/h17-19H2,1-16H3/q+1.
What are the key properties of bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium?
bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium has a molecular weight of 529.16 g/mol, XLogP of 6.08, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]methyl]-ethyl-methylazanium is sourced from PubChem (CID 161237231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).