1-triethoxysilyl-N-trimethylsilylethanamine

C11H29NO3Si2 — CID 89350066

IUPAC1-triethoxysilyl-N-trimethylsilylethanamine
SMILESCCO[Si](OCC)(OCC)C(C)N[Si](C)(C)C
InChIInChI=1S/C11H29NO3Si2/c1-8-13-17(14-9-2,15-10-3)11(4)12-16(5,6)7/h11-12H,8-10H2,1-7H3
InChIKeyHIGMWOVSZOPQBL-UHFFFAOYSA-N
MW279.53 g/mol
LogP2.39
Rot. Bonds9

About 1-triethoxysilyl-N-trimethylsilylethanamine

1-triethoxysilyl-N-trimethylsilylethanamine (PubChem CID 89350066) has the molecular formula C11H29NO3Si2 and a molecular weight of 279.53 g/mol. Its IUPAC name is 1-triethoxysilyl-N-trimethylsilylethanamine.

Molecular Properties

Compound Name1-triethoxysilyl-N-trimethylsilylethanamine
PubChem CID89350066
Molecular FormulaC11H29NO3Si2
Molecular Weight279.53 g/mol
Exact Mass279.17
IUPAC Name1-triethoxysilyl-N-trimethylsilylethanamine
SMILESCCO[Si](OCC)(OCC)C(C)N[Si](C)(C)C
InChIInChI=1S/C11H29NO3Si2/c1-8-13-17(14-9-2,15-10-3)11(4)12-16(5,6)7/h11-12H,8-10H2,1-7H3
InChIKeyHIGMWOVSZOPQBL-UHFFFAOYSA-N
XLogP2.39
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.53
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 1-triethoxysilyl-N-trimethylsilylethanamine?
The IUPAC name of 1-triethoxysilyl-N-trimethylsilylethanamine (CID 89350066) is 1-triethoxysilyl-N-trimethylsilylethanamine.
What is the SMILES notation for 1-triethoxysilyl-N-trimethylsilylethanamine?
The canonical SMILES for 1-triethoxysilyl-N-trimethylsilylethanamine is CCO[Si](OCC)(OCC)C(C)N[Si](C)(C)C.
What is the InChIKey of 1-triethoxysilyl-N-trimethylsilylethanamine?
The InChIKey is HIGMWOVSZOPQBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H29NO3Si2/c1-8-13-17(14-9-2,15-10-3)11(4)12-16(5,6)7/h11-12H,8-10H2,1-7H3.
What are the key properties of 1-triethoxysilyl-N-trimethylsilylethanamine?
1-triethoxysilyl-N-trimethylsilylethanamine has a molecular weight of 279.53 g/mol, XLogP of 2.39, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-triethoxysilyl-N-trimethylsilylethanamine is sourced from PubChem (CID 89350066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).