3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane

C18H41N3O3Si — CID 153419971

IUPAC3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane
SMILESCCCN1CN(CCC)CN(CCC[Si](OCC)(OCC)OCC)C1
InChIInChI=1S/C18H41N3O3Si/c1-6-12-19-16-20(13-7-2)18-21(17-19)14-11-15-25(22-8-3,23-9-4)24-10-5/h6-18H2,1-5H3
InChIKeyJZVNDVJHKBCYBH-UHFFFAOYSA-N
MW375.63 g/mol
LogP3.04
Rot. Bonds14

About 3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane

3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane (PubChem CID 153419971) has the molecular formula C18H41N3O3Si and a molecular weight of 375.63 g/mol. Its IUPAC name is 3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane.

Molecular Properties

Compound Name3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane
PubChem CID153419971
Molecular FormulaC18H41N3O3Si
Molecular Weight375.63 g/mol
Exact Mass375.29
IUPAC Name3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane
SMILESCCCN1CN(CCC)CN(CCC[Si](OCC)(OCC)OCC)C1
InChIInChI=1S/C18H41N3O3Si/c1-6-12-19-16-20(13-7-2)18-21(17-19)14-11-15-25(22-8-3,23-9-4)24-10-5/h6-18H2,1-5H3
InChIKeyJZVNDVJHKBCYBH-UHFFFAOYSA-N
XLogP3.04
TPSA37.41 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.63
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

3-(3-butylimidazolidin-1-yl)propyl-diethoxy-methylsilane
CID 59927470
3-(3-ethenylimidazolidin-1-yl)propyl-triethoxysilane
CID 123281277
3-(2,4-dihydroimidazol-3-yl)propyl-triethoxysilane
CID 2760691
triethoxy-[3-[4-tri(propan-2-yl)silylpiperazin-1-yl]propyl]silane
CID 23150171
triethoxy-[3-[3-[3-(oxiran-2-ylmethoxy)propyl]imidazolidin-1-yl]propyl]silane
CID 140960756
triethoxy(10-triethoxysilyldecyl)silane
CID 14439044
triethoxy(henicosyl)silane
CID 141362894
triethoxy(pentyl)silane;hydrofluoride
CID 174582602
triethoxy(nonyl)silane;triethoxy(octyl)silane
CID 175508301
dodecyl(triethoxy)silane;tridecane
CID 174970002
triethoxy(nonyl)silane;hydrofluoride
CID 161088856
silane;triethoxy(tetradecyl)silane
CID 161365398

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane?
The IUPAC name of 3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane (CID 153419971) is 3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane.
What is the SMILES notation for 3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane?
The canonical SMILES for 3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane is CCCN1CN(CCC)CN(CCC[Si](OCC)(OCC)OCC)C1.
What is the InChIKey of 3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane?
The InChIKey is JZVNDVJHKBCYBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H41N3O3Si/c1-6-12-19-16-20(13-7-2)18-21(17-19)14-11-15-25(22-8-3,23-9-4)24-10-5/h6-18H2,1-5H3.
What are the key properties of 3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane?
3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane has a molecular weight of 375.63 g/mol, XLogP of 3.04, 14 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dipropyl-1,3,5-triazinan-1-yl)propyl-triethoxysilane is sourced from PubChem (CID 153419971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).