2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine)

C181H260N42O17 — CID 158152967

About 2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine)

2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine) (PubChem CID 158152967) has the molecular formula C181H260N42O17 and a molecular weight of 3296.35 g/mol. Its IUPAC name is 2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine).

Molecular Properties

• Compound Name: 2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine)
• PubChem CID: 158152967
• Molecular Formula: C181H260N42O17
• Molecular Weight: 3296.35 g/mol
• Exact Mass: 3294.08
• IUPAC Name: 2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine)
• SMILES: CCC.CCN(C)c1nc(N(C)CC)nc(N(C)CC)n1.CCN(C)c1nc(N(C)CC)nc(N(C)CC)n1.CCN(C)c1nc(N(C)CC)nc(N(C)CC)n1.CCN(C)c1nc(N(C)CC)nc(N(C)CN(C)c2nc(N(C)CC)nc(N(C)CC)n2)n1.CCN(C)c1nc(N)nc(N(C)CC)n1.CCN(C)c1nc(NC)nc(N(C)CC)n1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1
• InChI: InChI=1S/C21H40N12.3C12H24N6.C10H20N6.C9H18N6.17C6H6O.C3H8/c1-11-28(5)16-22-17(29(6)12-2)25-20(24-16)32(9)15-33(10)21-26-18(30(7)13-3)23-19(27-21)31(8)14-4;3*1-7-16(4)10-13-11(17(5)8-2)15-12(14-10)18(6)9-3;1-6-15(4)9-12-8(11-3)13-10(14-9)16(5)7-2;1-5-14(3)8-11-7(10)12-9(13-8)15(4)6-2;17*7-6-4-2-1-3-5-6;1-3-2/h11-15H2,1-10H3;3*7-9H2,1-6H3;6-7H2,1-5H3,(H,11,12,13,14);5-6H2,1-4H3,(H2,10,11,12,13);17*1-5,7H;3H2,1-2H3
• InChIKey: FVIOFGNROKLWBF-UHFFFAOYSA-N
• XLogP: 31.41
• TPSA: 714.21 Ų
• H-Bond Donors: 19
• H-Bond Acceptors: 59
• Rotatable Bonds: 39
• Heavy Atoms: 240
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3296.35
LogP ≤ 5	31.41
H-Bond Donors ≤ 5	19
H-Bond Acceptors ≤ 10	59

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine)?

The IUPAC name of 2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine) (CID 158152967) is 2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine).

What is the SMILES notation for 2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine)?

The canonical SMILES for 2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine) is CCC.CCN(C)c1nc(N(C)CC)nc(N(C)CC)n1.CCN(C)c1nc(N(C)CC)nc(N(C)CC)n1.CCN(C)c1nc(N(C)CC)nc(N(C)CC)n1.CCN(C)c1nc(N(C)CC)nc(N(C)CN(C)c2nc(N(C)CC)nc(N(C)CC)n2)n1.CCN(C)c1nc(N)nc(N(C)CC)n1.CCN(C)c1nc(NC)nc(N(C)CC)n1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.Oc1ccccc1.

What is the InChIKey of 2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine)?

The InChIKey is FVIOFGNROKLWBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H40N12.3C12H24N6.C10H20N6.C9H18N6.17C6H6O.C3H8/c1-11-28(5)16-22-17(29(6)12-2)25-20(24-16)32(9)15-33(10)21-26-18(30(7)13-3)23-19(27-21)31(8)14-4;3*1-7-16(4)10-13-11(17(5)8-2)15-12(14-10)18(6)9-3;1-6-15(4)9-12-8(11-3)13-10(14-9)16(5)7-2;1-5-14(3)8-11-7(10)12-9(13-8)15(4)6-2;17*7-6-4-2-1-3-5-6;1-3-2/h11-15H2,1-10H3;3*7-9H2,1-6H3;6-7H2,1-5H3,(H,11,12,13,14);5-6H2,1-4H3,(H2,10,11,12,13);17*1-5,7H;3H2,1-2H3.

What are the key properties of 2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine)?

2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine) has a molecular weight of 3296.35 g/mol, XLogP of 31.41, 39 rotatable bonds, 19 hydrogen bond donors, and 59 hydrogen bond acceptors.

Where does this data come from?

All data for 2-N-[[[4,6-bis[ethyl(methyl)amino]-1,3,5-triazin-2-yl]-methylamino]methyl]-4-N,6-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N-diethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine;phenol;propane;tris(2-N,4-N,6-N-triethyl-2-N,4-N,6-N-trimethyl-1,3,5-triazine-2,4,6-triamine) is sourced from PubChem (CID 158152967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).