1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane

C16H37NO5Si2 — CID 140943183

IUPAC1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane
SMILESCCO[Si](OCC)(OCC)C(CC)N1CCC[Si]1(OCC)OCC
InChIInChI=1S/C16H37NO5Si2/c1-7-16(24(20-10-4,21-11-5)22-12-6)17-14-13-15-23(17,18-8-2)19-9-3/h16H,7-15H2,1-6H3
InChIKeyFLCGAKMKQBQZSX-UHFFFAOYSA-N
MW379.65 g/mol
LogP3.07
Rot. Bonds13

About 1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane

1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane (PubChem CID 140943183) has the molecular formula C16H37NO5Si2 and a molecular weight of 379.65 g/mol. Its IUPAC name is 1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane.

Molecular Properties

Compound Name1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane
PubChem CID140943183
Molecular FormulaC16H37NO5Si2
Molecular Weight379.65 g/mol
Exact Mass379.22
IUPAC Name1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane
SMILESCCO[Si](OCC)(OCC)C(CC)N1CCC[Si]1(OCC)OCC
InChIInChI=1S/C16H37NO5Si2/c1-7-16(24(20-10-4,21-11-5)22-12-6)17-14-13-15-23(17,18-8-2)19-9-3/h16H,7-15H2,1-6H3
InChIKeyFLCGAKMKQBQZSX-UHFFFAOYSA-N
XLogP3.07
TPSA49.39 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.65
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane?
The IUPAC name of 1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane (CID 140943183) is 1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane.
What is the SMILES notation for 1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane?
The canonical SMILES for 1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane is CCO[Si](OCC)(OCC)C(CC)N1CCC[Si]1(OCC)OCC.
What is the InChIKey of 1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane?
The InChIKey is FLCGAKMKQBQZSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H37NO5Si2/c1-7-16(24(20-10-4,21-11-5)22-12-6)17-14-13-15-23(17,18-8-2)19-9-3/h16H,7-15H2,1-6H3.
What are the key properties of 1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane?
1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane has a molecular weight of 379.65 g/mol, XLogP of 3.07, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-diethoxyazasilolidin-1-yl)propyl-triethoxysilane is sourced from PubChem (CID 140943183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).