N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine

C118H212N26O8 — CID 22068158

About N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine

N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine (PubChem CID 22068158) has the molecular formula C118H212N26O8 and a molecular weight of 2123.17 g/mol. Its IUPAC name is N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine.

Molecular Properties

• Compound Name: N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine
• PubChem CID: 22068158
• Molecular Formula: C118H212N26O8
• Molecular Weight: 2123.17 g/mol
• Exact Mass: 2121.70
• IUPAC Name: N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine
• SMILES: CN1C(C)(C)CC(Oc2nc(OC3CC(C)(C)N(C)C(C)(C)C3)nc(N(CCCN(c3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)C3CC(C)(C)NC(C)(C)C3)CCN(CCCN(c3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)C3CC(C)(C)NC(C)(C)C3)c3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)n2)CC1(C)C
• InChI: InChI=1S/C118H212N26O8/c1-99(2)57-77(58-100(3,4)131-99)143(89-123-95(149-83-69-111(25,26)137(45)112(27,28)70-83)129-96(124-89)150-84-71-113(29,30)138(46)114(31,32)72-84)53-49-51-141(87-119-91(145-79-61-103(9,10)133(41)104(11,12)62-79)127-92(120-87)146-80-63-105(13,14)134(42)106(15,16)64-80)55-56-142(88-121-93(147-81-65-107(17,18)135(43)108(19,20)66-81)128-94(122-88)148-82-67-109(21,22)136(44)110(23,24)68-82)52-50-54-144(78-59-101(5,6)132-102(7,8)60-78)90-125-97(151-85-73-115(33,34)139(47)116(35,36)74-85)130-98(126-90)152-86-75-117(37,38)140(48)118(39,40)76-86/h77-86,131-132H,49-76H2,1-48H3
• InChIKey: VYCVTWKAEBJMLS-UHFFFAOYSA-N
• XLogP: 19.39
• TPSA: 291.46 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 34
• Rotatable Bonds: 33
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2123.17
LogP ≤ 5	19.39
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	34

Frequently Asked Questions

What is the IUPAC name of N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine?

The IUPAC name of N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine (CID 22068158) is N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine.

What is the SMILES notation for N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine?

The canonical SMILES for N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine is CN1C(C)(C)CC(Oc2nc(OC3CC(C)(C)N(C)C(C)(C)C3)nc(N(CCCN(c3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)C3CC(C)(C)NC(C)(C)C3)CCN(CCCN(c3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)C3CC(C)(C)NC(C)(C)C3)c3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)n2)CC1(C)C.

What is the InChIKey of N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine?

The InChIKey is VYCVTWKAEBJMLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C118H212N26O8/c1-99(2)57-77(58-100(3,4)131-99)143(89-123-95(149-83-69-111(25,26)137(45)112(27,28)70-83)129-96(124-89)150-84-71-113(29,30)138(46)114(31,32)72-84)53-49-51-141(87-119-91(145-79-61-103(9,10)133(41)104(11,12)62-79)127-92(120-87)146-80-63-105(13,14)134(42)106(15,16)64-80)55-56-142(88-121-93(147-81-65-107(17,18)135(43)108(19,20)66-81)128-94(122-88)148-82-67-109(21,22)136(44)110(23,24)68-82)52-50-54-144(78-59-101(5,6)132-102(7,8)60-78)90-125-97(151-85-73-115(33,34)139(47)116(35,36)74-85)130-98(126-90)152-86-75-117(37,38)140(48)118(39,40)76-86/h77-86,131-132H,49-76H2,1-48H3.

What are the key properties of N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine?

N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine has a molecular weight of 2123.17 g/mol, XLogP of 19.39, 33 rotatable bonds, 2 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for N,N'-bis[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-N-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-[3-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-(2,2,6,6-tetramethylpiperidin-4-yl)amino]propyl]amino]ethyl]-N'-(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine is sourced from PubChem (CID 22068158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).