2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine

C83H152N16O4 — CID 18716466

About 2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine

2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 18716466) has the molecular formula C83H152N16O4 and a molecular weight of 1438.24 g/mol. Its IUPAC name is 2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

• Compound Name: 2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
• PubChem CID: 18716466
• Molecular Formula: C83H152N16O4
• Molecular Weight: 1438.24 g/mol
• Exact Mass: 1437.22
• IUPAC Name: 2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
• SMILES: CCCCN(c1nc(N(CCC)CNc2nc(N(CCCC)C3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)nc(N(CCCC)C3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)n2)nc(N(C)C2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)n1)C1CC(C)(C)N(OC2CCCCC2)C(C)(C)C1
• InChI: InChI=1S/C83H152N16O4/c1-22-26-50-93(63-55-78(9,10)97(79(11,12)56-63)101-67-43-35-30-36-44-67)73-85-70(86-74(90-73)94(51-27-23-2)64-57-80(13,14)98(81(15,16)58-64)102-68-45-37-31-38-46-68)84-61-92(49-25-4)72-87-71(91(21)62-53-76(5,6)96(77(7,8)54-62)100-66-41-33-29-34-42-66)88-75(89-72)95(52-28-24-3)65-59-82(17,18)99(83(19,20)60-65)103-69-47-39-32-40-48-69/h62-69H,22-61H2,1-21H3,(H,84,85,86,90)
• InChIKey: BERINFGDSKVYEZ-UHFFFAOYSA-N
• XLogP: 18.74
• TPSA: 155.45 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 20
• Rotatable Bonds: 31
• Heavy Atoms: 103
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1438.24
LogP ≤ 5	18.74
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	20

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-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?

The IUPAC name of 2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (CID 18716466) is 2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.

What is the SMILES notation for 2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?

The canonical SMILES for 2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine is CCCCN(c1nc(N(CCC)CNc2nc(N(CCCC)C3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)nc(N(CCCC)C3CC(C)(C)N(OC4CCCCC4)C(C)(C)C3)n2)nc(N(C)C2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)n1)C1CC(C)(C)N(OC2CCCCC2)C(C)(C)C1.

What is the InChIKey of 2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?

The InChIKey is BERINFGDSKVYEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C83H152N16O4/c1-22-26-50-93(63-55-78(9,10)97(79(11,12)56-63)101-67-43-35-30-36-44-67)73-85-70(86-74(90-73)94(51-27-23-2)64-57-80(13,14)98(81(15,16)58-64)102-68-45-37-31-38-46-68)84-61-92(49-25-4)72-87-71(91(21)62-53-76(5,6)96(77(7,8)54-62)100-66-41-33-29-34-42-66)88-75(89-72)95(52-28-24-3)65-59-82(17,18)99(83(19,20)60-65)103-69-47-39-32-40-48-69/h62-69H,22-61H2,1-21H3,(H,84,85,86,90).

What are the key properties of 2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?

2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 1438.24 g/mol, XLogP of 18.74, 31 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2-N,4-N-dibutyl-6-N-[[[4-[butyl-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-methylamino]-1,3,5-triazin-2-yl]-propylamino]methyl]-2-N,4-N-bis(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 18716466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).