2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine

C70H136N16 — CID 158901910

IUPAC2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
SMILESCCCCN(c1nc(N(C)CCC)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1)C1CC(C)(C)N(C)C(C)(C)C1.CCCCNc1nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1
InChIInChI=1S/2C35H68N8/c1-15-18-21-42(27-23-32(4,5)40(13)33(6,7)24-27)30-36-29(39(12)20-17-3)37-31(38-30)43(22-19-16-2)28-25-34(8,9)41(14)35(10,11)26-28;1-14-17-20-36-29-37-30(42(21-18-15-2)27-23-32(4,5)40(12)33(6,7)24-27)39-31(38-29)43(22-19-16-3)28-25-34(8,9)41(13)35(10,11)26-28/h27-28H,15-26H2,1-14H3;27-28H,14-26H2,1-13H3,(H,36,37,38,39)
InChIKeyJFOBOFHFASPUSB-UHFFFAOYSA-N
MW1201.97 g/mol
LogP14.83
Rot. Bonds27

About 2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine

2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 158901910) has the molecular formula C70H136N16 and a molecular weight of 1201.97 g/mol. Its IUPAC name is 2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
PubChem CID158901910
Molecular FormulaC70H136N16
Molecular Weight1201.97 g/mol
Exact Mass1201.11
IUPAC Name2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
SMILESCCCCN(c1nc(N(C)CCC)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1)C1CC(C)(C)N(C)C(C)(C)C1.CCCCNc1nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1
InChIInChI=1S/2C35H68N8/c1-15-18-21-42(27-23-32(4,5)40(13)33(6,7)24-27)30-36-29(39(12)20-17-3)37-31(38-30)43(22-19-16-2)28-25-34(8,9)41(14)35(10,11)26-28;1-14-17-20-36-29-37-30(42(21-18-15-2)27-23-32(4,5)40(12)33(6,7)24-27)39-31(38-29)43(22-19-16-3)28-25-34(8,9)41(13)35(10,11)26-28/h27-28H,15-26H2,1-14H3;27-28H,14-26H2,1-13H3,(H,36,37,38,39)
InChIKeyJFOBOFHFASPUSB-UHFFFAOYSA-N
XLogP14.83
TPSA118.53 Ų
H-Bond Donors1
H-Bond Acceptors16
Rotatable Bonds27
Heavy Atoms86
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001201.97
LogP ≤ 514.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (CID 158901910) is 2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine is CCCCN(c1nc(N(C)CCC)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1)C1CC(C)(C)N(C)C(C)(C)C1.CCCCNc1nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1.
What is the InChIKey of 2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is JFOBOFHFASPUSB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C35H68N8/c1-15-18-21-42(27-23-32(4,5)40(13)33(6,7)24-27)30-36-29(39(12)20-17-3)37-31(38-30)43(22-19-16-2)28-25-34(8,9)41(14)35(10,11)26-28;1-14-17-20-36-29-37-30(42(21-18-15-2)27-23-32(4,5)40(12)33(6,7)24-27)39-31(38-29)43(22-19-16-3)28-25-34(8,9)41(13)35(10,11)26-28/h27-28H,15-26H2,1-14H3;27-28H,14-26H2,1-13H3,(H,36,37,38,39).
What are the key properties of 2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 1201.97 g/mol, XLogP of 14.83, 27 rotatable bonds, 1 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N,4-N,6-N-tributyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 158901910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).