1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione

C99H123N27O27 — CID 160597146

About 1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione

1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione (PubChem CID 160597146) has the molecular formula C99H123N27O27 and a molecular weight of 2123.23 g/mol. Its IUPAC name is 1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione.

Molecular Properties

• Compound Name: 1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione
• PubChem CID: 160597146
• Molecular Formula: C99H123N27O27
• Molecular Weight: 2123.23 g/mol
• Exact Mass: 2121.91
• IUPAC Name: 1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione
• SMILES: C#Cn1c(=O)n(C)c(=O)n(C#C)c1=O.C=C(C)Cn1c(=O)[nH]c(=O)n(CC(=C)C)c1=O.C=C(C)Cn1c(=O)n(CC(=C)C)c(=O)n(CC(=C)C)c1=O.C=CCCn1c(=O)n(C)c(=O)n(CCC=C)c1=O.C=CCCn1c(=O)n(CCC=C)c(=O)n(CCC=C)c1=O.C=CCn1c(=O)[nH]c(=O)n(CC=C)c1=O.C=CCn1c(=O)n(CC=C)c(=O)n(CC=C)c1=O.C=Cn1c(=O)n(C)c(=O)n(C=C)c1=O.C=Cn1c(=O)n(C=C)c(=O)n(C=C)c1=O
• InChI: InChI=1S/2C15H21N3O3.C12H17N3O3.C12H15N3O3.C11H15N3O3.C9H9N3O3.C9H11N3O3.C8H9N3O3.C8H5N3O3/c1-10(2)7-16-13(19)17(8-11(3)4)15(21)18(14(16)20)9-12(5)6;1-4-7-10-16-13(19)17(11-8-5-2)15(21)18(14(16)20)12-9-6-3;1-4-6-8-14-10(16)13(3)11(17)15(12(14)18)9-7-5-2;1-4-7-13-10(16)14(8-5-2)12(18)15(9-6-3)11(13)17;1-7(2)5-13-9(15)12-10(16)14(11(13)17)6-8(3)4;1-4-10-7(13)11(5-2)9(15)12(6-3)8(10)14;1-3-5-11-7(13)10-8(14)12(6-4-2)9(11)15;2*1-4-10-6(12)9(3)7(13)11(5-2)8(10)14/h1,3,5,7-9H2,2,4,6H3;4-6H,1-3,7-12H2;4-5H,1-2,6-9H2,3H3;4-6H,1-3,7-9H2;1,3,5-6H2,2,4H3,(H,12,15,16);4-6H,1-3H2;3-4H,1-2,5-6H2,(H,10,13,14);4-5H,1-2H2,3H3;1-2H,3H3
• InChIKey: RDTYQFQGEVQFAZ-UHFFFAOYSA-N
• XLogP: -3.72
• TPSA: 615.72 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 52
• Rotatable Bonds: 40
• Heavy Atoms: 153
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2123.23
LogP ≤ 5	-3.72
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	52

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione?

The IUPAC name of 1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione (CID 160597146) is 1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione.

What is the SMILES notation for 1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione?

The canonical SMILES for 1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione is C#Cn1c(=O)n(C)c(=O)n(C#C)c1=O.C=C(C)Cn1c(=O)[nH]c(=O)n(CC(=C)C)c1=O.C=C(C)Cn1c(=O)n(CC(=C)C)c(=O)n(CC(=C)C)c1=O.C=CCCn1c(=O)n(C)c(=O)n(CCC=C)c1=O.C=CCCn1c(=O)n(CCC=C)c(=O)n(CCC=C)c1=O.C=CCn1c(=O)[nH]c(=O)n(CC=C)c1=O.C=CCn1c(=O)n(CC=C)c(=O)n(CC=C)c1=O.C=Cn1c(=O)n(C)c(=O)n(C=C)c1=O.C=Cn1c(=O)n(C=C)c(=O)n(C=C)c1=O.

What is the InChIKey of 1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione?

The InChIKey is RDTYQFQGEVQFAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H21N3O3.C12H17N3O3.C12H15N3O3.C11H15N3O3.C9H9N3O3.C9H11N3O3.C8H9N3O3.C8H5N3O3/c1-10(2)7-16-13(19)17(8-11(3)4)15(21)18(14(16)20)9-12(5)6;1-4-7-10-16-13(19)17(11-8-5-2)15(21)18(14(16)20)12-9-6-3;1-4-6-8-14-10(16)13(3)11(17)15(12(14)18)9-7-5-2;1-4-7-13-10(16)14(8-5-2)12(18)15(9-6-3)11(13)17;1-7(2)5-13-9(15)12-10(16)14(11(13)17)6-8(3)4;1-4-10-7(13)11(5-2)9(15)12(6-3)8(10)14;1-3-5-11-7(13)10-8(14)12(6-4-2)9(11)15;2*1-4-10-6(12)9(3)7(13)11(5-2)8(10)14/h1,3,5,7-9H2,2,4,6H3;4-6H,1-3,7-12H2;4-5H,1-2,6-9H2,3H3;4-6H,1-3,7-9H2;1,3,5-6H2,2,4H3,(H,12,15,16);4-6H,1-3H2;3-4H,1-2,5-6H2,(H,10,13,14);4-5H,1-2H2,3H3;1-2H,3H3.

What are the key properties of 1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione?

1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione has a molecular weight of 2123.23 g/mol, XLogP of -3.72, 40 rotatable bonds, 2 hydrogen bond donors, and 52 hydrogen bond acceptors.

Where does this data come from?

All data for 1,3-bis(but-3-enyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(ethenyl)-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3-bis(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3-diethynyl-5-methyl-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(but-3-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(ethenyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(2-methylprop-2-enyl)-1,3,5-triazinane-2,4,6-trione;1,3,5-tris(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione is sourced from PubChem (CID 160597146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).