6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine

C33H62N8 — CID 143681738

About 6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine

6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 143681738) has the molecular formula C33H62N8 and a molecular weight of 570.92 g/mol. Its IUPAC name is 6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

• Compound Name: 6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
• PubChem CID: 143681738
• Molecular Formula: C33H62N8
• Molecular Weight: 570.92 g/mol
• Exact Mass: 570.51
• IUPAC Name: 6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
• SMILES: CCCCCCN(c1nc(NC2CCCCC2)nc(NC2CC(C)(C)NC(C)(C)C2)n1)C1CC(C)(C)NC(C)(C)C1
• InChI: InChI=1S/C33H62N8/c1-10-11-12-16-19-41(26-22-32(6,7)40-33(8,9)23-26)29-37-27(34-24-17-14-13-15-18-24)36-28(38-29)35-25-20-30(2,3)39-31(4,5)21-25/h24-26,39-40H,10-23H2,1-9H3,(H2,34,35,36,37,38)
• InChIKey: KXTKUELSYJZWIK-UHFFFAOYSA-N
• XLogP: 7.03
• TPSA: 90.03 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 8
• Rotatable Bonds: 11
• Heavy Atoms: 41
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	570.92
LogP ≤ 5	7.03
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?

The IUPAC name of 6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (CID 143681738) is 6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.

What is the SMILES notation for 6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?

The canonical SMILES for 6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine is CCCCCCN(c1nc(NC2CCCCC2)nc(NC2CC(C)(C)NC(C)(C)C2)n1)C1CC(C)(C)NC(C)(C)C1.

What is the InChIKey of 6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?

The InChIKey is KXTKUELSYJZWIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H62N8/c1-10-11-12-16-19-41(26-22-32(6,7)40-33(8,9)23-26)29-37-27(34-24-17-14-13-15-18-24)36-28(38-29)35-25-20-30(2,3)39-31(4,5)21-25/h24-26,39-40H,10-23H2,1-9H3,(H2,34,35,36,37,38).

What are the key properties of 6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?

6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 570.92 g/mol, XLogP of 7.03, 11 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 6-N-cyclohexyl-2-N-hexyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 143681738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).