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

C70H134N16 — CID 19888789

IUPAC6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-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)CCCCCCN(C)c2nc(N(CCCC)C3CC(C)(C)N(C)C(C)(C)C3)nc(N(CCCC)C3CC(C)(C)N(C)C(C)(C)C3)n2)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1)C1CC(C)(C)N(C)C(C)(C)C1
InChIInChI=1S/C70H134N16/c1-27-31-41-83(53-45-63(5,6)79(23)64(7,8)46-53)59-71-57(72-60(75-59)84(42-32-28-2)54-47-65(9,10)80(24)66(11,12)48-54)77(21)39-37-35-36-38-40-78(22)58-73-61(85(43-33-29-3)55-49-67(13,14)81(25)68(15,16)50-55)76-62(74-58)86(44-34-30-4)56-51-69(17,18)82(26)70(19,20)52-56/h53-56H,27-52H2,1-26H3
InChIKeyQMHZRADXMFJVSJ-UHFFFAOYSA-N
MW1199.95 g/mol
LogP14.22
Rot. Bonds29

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

6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 19888789) has the molecular formula C70H134N16 and a molecular weight of 1199.95 g/mol. Its IUPAC name is 6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
PubChem CID19888789
Molecular FormulaC70H134N16
Molecular Weight1199.95 g/mol
Exact Mass1199.10
IUPAC Name6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-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)CCCCCCN(C)c2nc(N(CCCC)C3CC(C)(C)N(C)C(C)(C)C3)nc(N(CCCC)C3CC(C)(C)N(C)C(C)(C)C3)n2)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1)C1CC(C)(C)N(C)C(C)(C)C1
InChIInChI=1S/C70H134N16/c1-27-31-41-83(53-45-63(5,6)79(23)64(7,8)46-53)59-71-57(72-60(75-59)84(42-32-28-2)54-47-65(9,10)80(24)66(11,12)48-54)77(21)39-37-35-36-38-40-78(22)58-73-61(85(43-33-29-3)55-49-67(13,14)81(25)68(15,16)50-55)76-62(74-58)86(44-34-30-4)56-51-69(17,18)82(26)70(19,20)52-56/h53-56H,27-52H2,1-26H3
InChIKeyQMHZRADXMFJVSJ-UHFFFAOYSA-N
XLogP14.22
TPSA109.74 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds29
Heavy Atoms86
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001199.95
LogP ≤ 514.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-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 6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine (CID 19888789) is 6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-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 6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-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 6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-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)CCCCCCN(C)c2nc(N(CCCC)C3CC(C)(C)N(C)C(C)(C)C3)nc(N(CCCC)C3CC(C)(C)N(C)C(C)(C)C3)n2)nc(N(CCCC)C2CC(C)(C)N(C)C(C)(C)C2)n1)C1CC(C)(C)N(C)C(C)(C)C1.
What is the InChIKey of 6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is QMHZRADXMFJVSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H134N16/c1-27-31-41-83(53-45-63(5,6)79(23)64(7,8)46-53)59-71-57(72-60(75-59)84(42-32-28-2)54-47-65(9,10)80(24)66(11,12)48-54)77(21)39-37-35-36-38-40-78(22)58-73-61(85(43-33-29-3)55-49-67(13,14)81(25)68(15,16)50-55)76-62(74-58)86(44-34-30-4)56-51-69(17,18)82(26)70(19,20)52-56/h53-56H,27-52H2,1-26H3.
What are the key properties of 6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine?
6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-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 1199.95 g/mol, XLogP of 14.22, 29 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-[6-[[4,6-bis[butyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]-methylamino]hexyl]-2-N,4-N-dibutyl-6-N-methyl-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 19888789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).