N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine

C16H41NO2Si3 — CID 149160399

IUPACN-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine
SMILESCCO[Si](C)(CCN([Si](C)(C)C)[Si](C)(C)C(C)(C)C)OCC
InChIInChI=1S/C16H41NO2Si3/c1-12-18-22(11,19-13-2)15-14-17(20(6,7)8)21(9,10)16(3,4)5/h12-15H2,1-11H3
InChIKeyVAARTVJKOLGWHW-UHFFFAOYSA-N
MW363.77 g/mol
LogP5.27
Rot. Bonds9

About N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine

N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine (PubChem CID 149160399) has the molecular formula C16H41NO2Si3 and a molecular weight of 363.77 g/mol. Its IUPAC name is N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine.

Molecular Properties

Compound NameN-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine
PubChem CID149160399
Molecular FormulaC16H41NO2Si3
Molecular Weight363.77 g/mol
Exact Mass363.24
IUPAC NameN-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine
SMILESCCO[Si](C)(CCN([Si](C)(C)C)[Si](C)(C)C(C)(C)C)OCC
InChIInChI=1S/C16H41NO2Si3/c1-12-18-22(11,19-13-2)15-14-17(20(6,7)8)21(9,10)16(3,4)5/h12-15H2,1-11H3
InChIKeyVAARTVJKOLGWHW-UHFFFAOYSA-N
XLogP5.27
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.77
LogP ≤ 55.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine?
The IUPAC name of N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine (CID 149160399) is N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine.
What is the SMILES notation for N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine?
The canonical SMILES for N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine is CCO[Si](C)(CCN([Si](C)(C)C)[Si](C)(C)C(C)(C)C)OCC.
What is the InChIKey of N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine?
The InChIKey is VAARTVJKOLGWHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H41NO2Si3/c1-12-18-22(11,19-13-2)15-14-17(20(6,7)8)21(9,10)16(3,4)5/h12-15H2,1-11H3.
What are the key properties of N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine?
N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine has a molecular weight of 363.77 g/mol, XLogP of 5.27, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[tert-butyl(dimethyl)silyl]-2-[diethoxy(methyl)silyl]-N-trimethylsilylethanamine is sourced from PubChem (CID 149160399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).