1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione

C87H161N15O41Si8 — CID 160942499

IUPAC1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione
SMILESC=CCn1c(=O)n(CC=C)c(=O)n(CCC[Si](OC)(OC)OC)c1=O.C=CCn1c(=O)n(CCC[Si](OC)(OC)OC)c(=O)n(CC2CO2)c1=O.C=CCn1c(=O)n(CCC[Si](OC)(OC)OC)c(=O)n(CCC[Si](OC)(OC)OC)c1=O.C=CCn1c(=O)n(CCC[Si](OCC)(OCC)OCC)c(=O)n(CC2CO2)c1=O.CO[Si](CO)(CCCn1c(=O)n(CCC[Si](OC)(OC)OC)c(=O)n(CCC[Si](OC)(OC)OC)c1=O)OC
InChIInChI=1S/C21H45N3O12Si3.C18H35N3O9Si2.C18H31N3O7Si.C15H25N3O7Si.C15H25N3O6Si/c1-29-37(18-25,30-2)15-9-12-22-19(26)23(13-10-16-38(31-3,32-4)33-5)21(28)24(20(22)27)14-11-17-39(34-6,35-7)36-8;1-8-11-19-16(22)20(12-9-14-31(25-2,26-3)27-4)18(24)21(17(19)23)13-10-15-32(28-5,29-6)30-7;1-5-10-19-16(22)20(18(24)21(17(19)23)13-15-14-25-15)11-9-12-29(26-6-2,27-7-3)28-8-4;1-5-7-16-13(19)17(8-6-9-26(22-2,23-3)24-4)15(21)18(14(16)20)10-12-11-25-12;1-6-9-16-13(19)17(10-7-2)15(21)18(14(16)20)11-8-12-25(22-3,23-4)24-5/h25H,9-18H2,1-8H3;8H,1,9-15H2,2-7H3;5,15H,1,6-14H2,2-4H3;5,12H,1,6-11H2,2-4H3;6-7H,1-2,8-12H2,3-5H3
InChIKeySURKUMGGNXWFIT-UHFFFAOYSA-N
MW2298.00 g/mol
LogP-1.71
Rot. Bonds73

About 1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione

1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione (PubChem CID 160942499) has the molecular formula C87H161N15O41Si8 and a molecular weight of 2298.00 g/mol. Its IUPAC name is 1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione.

Molecular Properties

Compound Name1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione
PubChem CID160942499
Molecular FormulaC87H161N15O41Si8
Molecular Weight2298.00 g/mol
Exact Mass2295.91
IUPAC Name1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione
SMILESC=CCn1c(=O)n(CC=C)c(=O)n(CCC[Si](OC)(OC)OC)c1=O.C=CCn1c(=O)n(CCC[Si](OC)(OC)OC)c(=O)n(CC2CO2)c1=O.C=CCn1c(=O)n(CCC[Si](OC)(OC)OC)c(=O)n(CCC[Si](OC)(OC)OC)c1=O.C=CCn1c(=O)n(CCC[Si](OCC)(OCC)OCC)c(=O)n(CC2CO2)c1=O.CO[Si](CO)(CCCn1c(=O)n(CCC[Si](OC)(OC)OC)c(=O)n(CCC[Si](OC)(OC)OC)c1=O)OC
InChIInChI=1S/C21H45N3O12Si3.C18H35N3O9Si2.C18H31N3O7Si.C15H25N3O7Si.C15H25N3O6Si/c1-29-37(18-25,30-2)15-9-12-22-19(26)23(13-10-16-38(31-3,32-4)33-5)21(28)24(20(22)27)14-11-17-39(34-6,35-7)36-8;1-8-11-19-16(22)20(12-9-14-31(25-2,26-3)27-4)18(24)21(17(19)23)13-10-15-32(28-5,29-6)30-7;1-5-10-19-16(22)20(18(24)21(17(19)23)13-15-14-25-15)11-9-12-29(26-6-2,27-7-3)28-8-4;1-5-7-16-13(19)17(8-6-9-26(22-2,23-3)24-4)15(21)18(14(16)20)10-12-11-25-12;1-6-9-16-13(19)17(10-7-2)15(21)18(14(16)20)11-8-12-25(22-3,23-4)24-5/h25H,9-18H2,1-8H3;8H,1,9-15H2,2-7H3;5,15H,1,6-14H2,2-4H3;5,12H,1,6-11H2,2-4H3;6-7H,1-2,8-12H2,3-5H3
InChIKeySURKUMGGNXWFIT-UHFFFAOYSA-N
XLogP-1.71
TPSA587.58 Ų
H-Bond Donors1
H-Bond Acceptors56
Rotatable Bonds73
Heavy Atoms151
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002298.00
LogP ≤ 5-1.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1056

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze 1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione?
The IUPAC name of 1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione (CID 160942499) is 1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione.
What is the SMILES notation for 1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione?
The canonical SMILES for 1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione is C=CCn1c(=O)n(CC=C)c(=O)n(CCC[Si](OC)(OC)OC)c1=O.C=CCn1c(=O)n(CCC[Si](OC)(OC)OC)c(=O)n(CC2CO2)c1=O.C=CCn1c(=O)n(CCC[Si](OC)(OC)OC)c(=O)n(CCC[Si](OC)(OC)OC)c1=O.C=CCn1c(=O)n(CCC[Si](OCC)(OCC)OCC)c(=O)n(CC2CO2)c1=O.CO[Si](CO)(CCCn1c(=O)n(CCC[Si](OC)(OC)OC)c(=O)n(CCC[Si](OC)(OC)OC)c1=O)OC.
What is the InChIKey of 1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione?
The InChIKey is SURKUMGGNXWFIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H45N3O12Si3.C18H35N3O9Si2.C18H31N3O7Si.C15H25N3O7Si.C15H25N3O6Si/c1-29-37(18-25,30-2)15-9-12-22-19(26)23(13-10-16-38(31-3,32-4)33-5)21(28)24(20(22)27)14-11-17-39(34-6,35-7)36-8;1-8-11-19-16(22)20(12-9-14-31(25-2,26-3)27-4)18(24)21(17(19)23)13-10-15-32(28-5,29-6)30-7;1-5-10-19-16(22)20(18(24)21(17(19)23)13-15-14-25-15)11-9-12-29(26-6-2,27-7-3)28-8-4;1-5-7-16-13(19)17(8-6-9-26(22-2,23-3)24-4)15(21)18(14(16)20)10-12-11-25-12;1-6-9-16-13(19)17(10-7-2)15(21)18(14(16)20)11-8-12-25(22-3,23-4)24-5/h25H,9-18H2,1-8H3;8H,1,9-15H2,2-7H3;5,15H,1,6-14H2,2-4H3;5,12H,1,6-11H2,2-4H3;6-7H,1-2,8-12H2,3-5H3.
What are the key properties of 1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione?
1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione has a molecular weight of 2298.00 g/mol, XLogP of -1.71, 73 rotatable bonds, 1 hydrogen bond donors, and 56 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(prop-2-enyl)-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-[3-[hydroxymethyl(dimethoxy)silyl]propyl]-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-triethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-(oxiran-2-ylmethyl)-3-prop-2-enyl-5-(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione;1-prop-2-enyl-3,5-bis(3-trimethoxysilylpropyl)-1,3,5-triazinane-2,4,6-trione is sourced from PubChem (CID 160942499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).