3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane

C15H25N3O6Si — CID 59335555

IUPAC3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane
SMILESC=CCOc1nc(OCC=C)nc(OCCC[Si](OC)(OC)OC)n1
InChIInChI=1S/C15H25N3O6Si/c1-6-9-22-13-16-14(23-10-7-2)18-15(17-13)24-11-8-12-25(19-3,20-4)21-5/h6-7H,1-2,8-12H2,3-5H3
InChIKeyMAVGZTYDECFVFY-UHFFFAOYSA-N
MW371.47 g/mol
LogP1.65
Rot. Bonds14

About 3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane

3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane (PubChem CID 59335555) has the molecular formula C15H25N3O6Si and a molecular weight of 371.47 g/mol. Its IUPAC name is 3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane.

Molecular Properties

Compound Name3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane
PubChem CID59335555
Molecular FormulaC15H25N3O6Si
Molecular Weight371.47 g/mol
Exact Mass371.15
IUPAC Name3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane
SMILESC=CCOc1nc(OCC=C)nc(OCCC[Si](OC)(OC)OC)n1
InChIInChI=1S/C15H25N3O6Si/c1-6-9-22-13-16-14(23-10-7-2)18-15(17-13)24-11-8-12-25(19-3,20-4)21-5/h6-7H,1-2,8-12H2,3-5H3
InChIKeyMAVGZTYDECFVFY-UHFFFAOYSA-N
XLogP1.65
TPSA94.05 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.47
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane?
The IUPAC name of 3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane (CID 59335555) is 3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane.
What is the SMILES notation for 3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane?
The canonical SMILES for 3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane is C=CCOc1nc(OCC=C)nc(OCCC[Si](OC)(OC)OC)n1.
What is the InChIKey of 3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane?
The InChIKey is MAVGZTYDECFVFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O6Si/c1-6-9-22-13-16-14(23-10-7-2)18-15(17-13)24-11-8-12-25(19-3,20-4)21-5/h6-7H,1-2,8-12H2,3-5H3.
What are the key properties of 3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane?
3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane has a molecular weight of 371.47 g/mol, XLogP of 1.65, 14 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4,6-bis(prop-2-enoxy)-1,3,5-triazin-2-yl]oxy]propyl-trimethoxysilane is sourced from PubChem (CID 59335555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).