triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane

C17H41N3O6Si2 — CID 67387259

IUPACtriethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane
SMILESCCO[Si](CN1CNCN(C[Si](OCC)(OCC)OCC)C1)(OCC)OCC
InChIInChI=1S/C17H41N3O6Si2/c1-7-21-27(22-8-2,23-9-3)16-19-13-18-14-20(15-19)17-28(24-10-4,25-11-5)26-12-6/h18H,7-17H2,1-6H3
InChIKeyWFLBWPQLIMSDNM-UHFFFAOYSA-N
MW439.70 g/mol
LogP1.24
Rot. Bonds16

About triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane

triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane (PubChem CID 67387259) has the molecular formula C17H41N3O6Si2 and a molecular weight of 439.70 g/mol. Its IUPAC name is triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane.

Molecular Properties

Compound Nametriethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane
PubChem CID67387259
Molecular FormulaC17H41N3O6Si2
Molecular Weight439.70 g/mol
Exact Mass439.25
IUPAC Nametriethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane
SMILESCCO[Si](CN1CNCN(C[Si](OCC)(OCC)OCC)C1)(OCC)OCC
InChIInChI=1S/C17H41N3O6Si2/c1-7-21-27(22-8-2,23-9-3)16-19-13-18-14-20(15-19)17-28(24-10-4,25-11-5)26-12-6/h18H,7-17H2,1-6H3
InChIKeyWFLBWPQLIMSDNM-UHFFFAOYSA-N
XLogP1.24
TPSA73.89 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds16
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.70
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Triethoxy(1,3,5-triazinan-1-ylmethyl)silane
CID 67387721
[3,5-Bis(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl-triethoxysilane
CID 67387813

Frequently Asked Questions

What is the IUPAC name of triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane?
The IUPAC name of triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane (CID 67387259) is triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane.
What is the SMILES notation for triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane?
The canonical SMILES for triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane is CCO[Si](CN1CNCN(C[Si](OCC)(OCC)OCC)C1)(OCC)OCC.
What is the InChIKey of triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane?
The InChIKey is WFLBWPQLIMSDNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H41N3O6Si2/c1-7-21-27(22-8-2,23-9-3)16-19-13-18-14-20(15-19)17-28(24-10-4,25-11-5)26-12-6/h18H,7-17H2,1-6H3.
What are the key properties of triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane?
triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane has a molecular weight of 439.70 g/mol, XLogP of 1.24, 16 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[[3-(triethoxysilylmethyl)-1,3,5-triazinan-1-yl]methyl]silane is sourced from PubChem (CID 67387259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).