N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine

C93H168N20O6 — CID 22068138

IUPACN,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine
SMILESCC1(C)CC(Oc2nc(OC3CC(C)(C)NC(C)(C)C3)nc(N(CCCCCCN(c3nc(OC4CC(C)(C)NC(C)(C)C4)nc(OC4CC(C)(C)NC(C)(C)C4)n3)C3CC(C)(C)NC(C)(C)C3)CCCCCCN(c3nc(OC4CC(C)(C)NC(C)(C)C4)nc(OC4CC(C)(C)NC(C)(C)C4)n3)C3CC(C)(C)NC(C)(C)C3)n2)CC(C)(C)N1
InChIInChI=1S/C93H168N20O6/c1-78(2)45-61(46-79(3,4)103-78)112(70-96-74(116-65-53-86(17,18)107-87(19,20)54-65)101-75(97-70)117-66-55-88(21,22)108-89(23,24)56-66)43-39-35-33-37-41-111(69-94-72(114-63-49-82(9,10)105-83(11,12)50-63)100-73(95-69)115-64-51-84(13,14)106-85(15,16)52-64)42-38-34-36-40-44-113(62-47-80(5,6)104-81(7,8)48-62)71-98-76(118-67-57-90(25,26)109-91(27,28)58-67)102-77(99-71)119-68-59-92(29,30)110-93(31,32)60-68/h61-68,103-110H,33-60H2,1-32H3
InChIKeyBIQNXKXRTVNKJJ-UHFFFAOYSA-N
MW1662.50 g/mol
LogP15.93
Rot. Bonds31

About N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine

N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine (PubChem CID 22068138) has the molecular formula C93H168N20O6 and a molecular weight of 1662.50 g/mol. Its IUPAC name is N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine.

Molecular Properties

Compound NameN,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine
PubChem CID22068138
Molecular FormulaC93H168N20O6
Molecular Weight1662.50 g/mol
Exact Mass1661.35
IUPAC NameN,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine
SMILESCC1(C)CC(Oc2nc(OC3CC(C)(C)NC(C)(C)C3)nc(N(CCCCCCN(c3nc(OC4CC(C)(C)NC(C)(C)C4)nc(OC4CC(C)(C)NC(C)(C)C4)n3)C3CC(C)(C)NC(C)(C)C3)CCCCCCN(c3nc(OC4CC(C)(C)NC(C)(C)C4)nc(OC4CC(C)(C)NC(C)(C)C4)n3)C3CC(C)(C)NC(C)(C)C3)n2)CC(C)(C)N1
InChIInChI=1S/C93H168N20O6/c1-78(2)45-61(46-79(3,4)103-78)112(70-96-74(116-65-53-86(17,18)107-87(19,20)54-65)101-75(97-70)117-66-55-88(21,22)108-89(23,24)56-66)43-39-35-33-37-41-111(69-94-72(114-63-49-82(9,10)105-83(11,12)50-63)100-73(95-69)115-64-51-84(13,14)106-85(15,16)52-64)42-38-34-36-40-44-113(62-47-80(5,6)104-81(7,8)48-62)71-98-76(118-67-57-90(25,26)109-91(27,28)58-67)102-77(99-71)119-68-59-92(29,30)110-93(31,32)60-68/h61-68,103-110H,33-60H2,1-32H3
InChIKeyBIQNXKXRTVNKJJ-UHFFFAOYSA-N
XLogP15.93
TPSA277.35 Ų
H-Bond Donors8
H-Bond Acceptors26
Rotatable Bonds31
Heavy Atoms119
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001662.50
LogP ≤ 515.93
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

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

Analyze N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine?
The IUPAC name of N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine (CID 22068138) is N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine.
What is the SMILES notation for N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine?
The canonical SMILES for N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine is CC1(C)CC(Oc2nc(OC3CC(C)(C)NC(C)(C)C3)nc(N(CCCCCCN(c3nc(OC4CC(C)(C)NC(C)(C)C4)nc(OC4CC(C)(C)NC(C)(C)C4)n3)C3CC(C)(C)NC(C)(C)C3)CCCCCCN(c3nc(OC4CC(C)(C)NC(C)(C)C4)nc(OC4CC(C)(C)NC(C)(C)C4)n3)C3CC(C)(C)NC(C)(C)C3)n2)CC(C)(C)N1.
What is the InChIKey of N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine?
The InChIKey is BIQNXKXRTVNKJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C93H168N20O6/c1-78(2)45-61(46-79(3,4)103-78)112(70-96-74(116-65-53-86(17,18)107-87(19,20)54-65)101-75(97-70)117-66-55-88(21,22)108-89(23,24)56-66)43-39-35-33-37-41-111(69-94-72(114-63-49-82(9,10)105-83(11,12)50-63)100-73(95-69)115-64-51-84(13,14)106-85(15,16)52-64)42-38-34-36-40-44-113(62-47-80(5,6)104-81(7,8)48-62)71-98-76(118-67-57-90(25,26)109-91(27,28)58-67)102-77(99-71)119-68-59-92(29,30)110-93(31,32)60-68/h61-68,103-110H,33-60H2,1-32H3.
What are the key properties of N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine?
N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine has a molecular weight of 1662.50 g/mol, XLogP of 15.93, 31 rotatable bonds, 8 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[6-[[4,6-bis[(2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine is sourced from PubChem (CID 22068138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).