6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane

C18H41NO4Si2 — CID 175874155

IUPAC6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane
SMILESCCO[Si](C)(CCCCCCN1CCC[Si]1(OCC)OCC)OCC
InChIInChI=1S/C18H41NO4Si2/c1-6-20-24(5,21-7-2)17-13-11-10-12-15-19-16-14-18-25(19,22-8-3)23-9-4/h6-18H2,1-5H3
InChIKeyMNVCITOKOZWIGW-UHFFFAOYSA-N
MW391.70 g/mol
LogP4.41
Rot. Bonds15

About 6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane

6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane (PubChem CID 175874155) has the molecular formula C18H41NO4Si2 and a molecular weight of 391.70 g/mol. Its IUPAC name is 6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane.

Molecular Properties

Compound Name6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane
PubChem CID175874155
Molecular FormulaC18H41NO4Si2
Molecular Weight391.70 g/mol
Exact Mass391.26
IUPAC Name6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane
SMILESCCO[Si](C)(CCCCCCN1CCC[Si]1(OCC)OCC)OCC
InChIInChI=1S/C18H41NO4Si2/c1-6-20-24(5,21-7-2)17-13-11-10-12-15-19-16-14-18-25(19,22-8-3)23-9-4/h6-18H2,1-5H3
InChIKeyMNVCITOKOZWIGW-UHFFFAOYSA-N
XLogP4.41
TPSA40.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds15
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.70
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane?
The IUPAC name of 6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane (CID 175874155) is 6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane.
What is the SMILES notation for 6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane?
The canonical SMILES for 6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane is CCO[Si](C)(CCCCCCN1CCC[Si]1(OCC)OCC)OCC.
What is the InChIKey of 6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane?
The InChIKey is MNVCITOKOZWIGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H41NO4Si2/c1-6-20-24(5,21-7-2)17-13-11-10-12-15-19-16-14-18-25(19,22-8-3)23-9-4/h6-18H2,1-5H3.
What are the key properties of 6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane?
6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane has a molecular weight of 391.70 g/mol, XLogP of 4.41, 15 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2-diethoxyazasilolidin-1-yl)hexyl-diethoxy-methylsilane is sourced from PubChem (CID 175874155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).