2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine

C92H136N48O — CID 157339292

About 2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine

2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine (PubChem CID 157339292) has the molecular formula C92H136N48O and a molecular weight of 1930.43 g/mol. Its IUPAC name is 2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

• Compound Name: 2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine
• PubChem CID: 157339292
• Molecular Formula: C92H136N48O
• Molecular Weight: 1930.43 g/mol
• Exact Mass: 1929.21
• IUPAC Name: 2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine
• SMILES: CN(C)c1nc(N)nc(N(C)CCC2=CCC=C2)n1.CN(C)c1nc(NCCC2=CCC=C2)nc(N(C)C)n1.CN(CCC1=CCC=C1)c1nc(N)nc(N)n1.CNc1nc(N)nc(N(C)CCC2=CCC=C2)n1.CNc1nc(N)nc(NCCC2=CCC=C2)n1.CNc1nc(NC)nc(NCCC2=CCC=C2)n1.Nc1nc(N)nc(NCCC2=CCC=C2)n1.Nc1nc(N)nc(NCCc2ccoc2)n1
• InChI: InChI=1S/C14H22N6.C13H20N6.2C12H18N6.2C11H16N6.C10H14N6.C9H12N6O/c1-19(2)13-16-12(17-14(18-13)20(3)4)15-10-9-11-7-5-6-8-11;1-18(2)12-15-11(14)16-13(17-12)19(3)9-8-10-6-4-5-7-10;1-14-11-15-10(13)16-12(17-11)18(2)8-7-9-5-3-4-6-9;1-13-10-16-11(14-2)18-12(17-10)15-8-7-9-5-3-4-6-9;1-17(7-6-8-4-2-3-5-8)11-15-9(12)14-10(13)16-11;1-13-10-15-9(12)16-11(17-10)14-7-6-8-4-2-3-5-8;11-8-14-9(12)16-10(15-8)13-6-5-7-3-1-2-4-7;10-7-13-8(11)15-9(14-7)12-3-1-6-2-4-16-5-6/h5,7-8H,6,9-10H2,1-4H3,(H,15,16,17,18);4,6-7H,5,8-9H2,1-3H3,(H2,14,15,16,17);3,5-6H,4,7-8H2,1-2H3,(H3,13,14,15,16,17);3,5-6H,4,7-8H2,1-2H3,(H3,13,14,15,16,17,18);2,4-5H,3,6-7H2,1H3,(H4,12,13,14,15,16);2,4-5H,3,6-7H2,1H3,(H4,12,13,14,15,16,17);1,3-4H,2,5-6H2,(H5,11,12,13,14,15,16);2,4-5H,1,3H2,(H5,10,11,12,13,14,15)
• InChIKey: BGFAUEIXZODXGG-UHFFFAOYSA-N
• XLogP: 8.72
• TPSA: 684.39 Ų
• H-Bond Donors: 18
• H-Bond Acceptors: 49
• Rotatable Bonds: 39
• Heavy Atoms: 141
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1930.43
LogP ≤ 5	8.72
H-Bond Donors ≤ 5	18
H-Bond Acceptors ≤ 10	49

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine?

The IUPAC name of 2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine (CID 157339292) is 2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine.

What is the SMILES notation for 2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine?

The canonical SMILES for 2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine is CN(C)c1nc(N)nc(N(C)CCC2=CCC=C2)n1.CN(C)c1nc(NCCC2=CCC=C2)nc(N(C)C)n1.CN(CCC1=CCC=C1)c1nc(N)nc(N)n1.CNc1nc(N)nc(N(C)CCC2=CCC=C2)n1.CNc1nc(N)nc(NCCC2=CCC=C2)n1.CNc1nc(NC)nc(NCCC2=CCC=C2)n1.Nc1nc(N)nc(NCCC2=CCC=C2)n1.Nc1nc(N)nc(NCCc2ccoc2)n1.

What is the InChIKey of 2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine?

The InChIKey is BGFAUEIXZODXGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6.C13H20N6.2C12H18N6.2C11H16N6.C10H14N6.C9H12N6O/c1-19(2)13-16-12(17-14(18-13)20(3)4)15-10-9-11-7-5-6-8-11;1-18(2)12-15-11(14)16-13(17-12)19(3)9-8-10-6-4-5-7-10;1-14-11-15-10(13)16-12(17-11)18(2)8-7-9-5-3-4-6-9;1-13-10-16-11(14-2)18-12(17-10)15-8-7-9-5-3-4-6-9;1-17(7-6-8-4-2-3-5-8)11-15-9(12)14-10(13)16-11;1-13-10-15-9(12)16-11(17-10)14-7-6-8-4-2-3-5-8;11-8-14-9(12)16-10(15-8)13-6-5-7-3-1-2-4-7;10-7-13-8(11)15-9(14-7)12-3-1-6-2-4-16-5-6/h5,7-8H,6,9-10H2,1-4H3,(H,15,16,17,18);4,6-7H,5,8-9H2,1-3H3,(H2,14,15,16,17);3,5-6H,4,7-8H2,1-2H3,(H3,13,14,15,16,17);3,5-6H,4,7-8H2,1-2H3,(H3,13,14,15,16,17,18);2,4-5H,3,6-7H2,1H3,(H4,12,13,14,15,16);2,4-5H,3,6-7H2,1H3,(H4,12,13,14,15,16,17);1,3-4H,2,5-6H2,(H5,11,12,13,14,15,16);2,4-5H,1,3H2,(H5,10,11,12,13,14,15).

What are the key properties of 2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine?

2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine has a molecular weight of 1930.43 g/mol, XLogP of 8.72, 39 rotatable bonds, 18 hydrogen bond donors, and 49 hydrogen bond acceptors.

Where does this data come from?

All data for 2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N,6-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-4-N-methyl-1,3,5-triazine-2,4,6-triamine;6-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-1,3,5-triazine-2,4,6-triamine;2-N-(2-cyclopenta-1,4-dien-1-ylethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N-[2-(furan-3-yl)ethyl]-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 157339292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).