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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-diamine

C98H174N24O8 — CID 22068153

IUPACN,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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-diamine
SMILESCN1C(C)(C)CC(Oc2nc(NCCN(CCN(CCNc3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)c3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)c3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)nc(OC3CC(C)(C)N(C)C(C)(C)C3)n2)CC1(C)C
InChIInChI=1S/C98H174N24O8/c1-83(2)47-63(48-84(3,4)113(83)33)123-75-101-71(102-76(109-75)124-64-49-85(5,6)114(34)86(7,8)50-64)99-41-43-121(73-105-79(127-67-55-91(17,18)117(37)92(19,20)56-67)111-80(106-73)128-68-57-93(21,22)118(38)94(23,24)58-68)45-46-122(74-107-81(129-69-59-95(25,26)119(39)96(27,28)60-69)112-82(108-74)130-70-61-97(29,30)120(40)98(31,32)62-70)44-42-100-72-103-77(125-65-51-87(9,10)115(35)88(11,12)52-65)110-78(104-72)126-66-53-89(13,14)116(36)90(15,16)54-66/h63-70H,41-62H2,1-40H3,(H,99,101,102,109)(H,100,103,104,110)
InChIKeyCIERWVNVCCCRJV-UHFFFAOYSA-N
MW1816.63 g/mol
LogP15.21
Rot. Bonds29

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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-diamine (PubChem CID 22068153) has the molecular formula C98H174N24O8 and a molecular weight of 1816.63 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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN,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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-diamine
PubChem CID22068153
Molecular FormulaC98H174N24O8
Molecular Weight1816.63 g/mol
Exact Mass1815.39
IUPAC NameN,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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-diamine
SMILESCN1C(C)(C)CC(Oc2nc(NCCN(CCN(CCNc3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)c3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)c3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)nc(OC3CC(C)(C)N(C)C(C)(C)C3)n2)CC1(C)C
InChIInChI=1S/C98H174N24O8/c1-83(2)47-63(48-84(3,4)113(83)33)123-75-101-71(102-76(109-75)124-64-49-85(5,6)114(34)86(7,8)50-64)99-41-43-121(73-105-79(127-67-55-91(17,18)117(37)92(19,20)56-67)111-80(106-73)128-68-57-93(21,22)118(38)94(23,24)58-68)45-46-122(74-107-81(129-69-59-95(25,26)119(39)96(27,28)60-69)112-82(108-74)130-70-61-97(29,30)120(40)98(31,32)62-70)44-42-100-72-103-77(125-65-51-87(9,10)115(35)88(11,12)52-65)110-78(104-72)126-66-53-89(13,14)116(36)90(15,16)54-66/h63-70H,41-62H2,1-40H3,(H,99,101,102,109)(H,100,103,104,110)
InChIKeyCIERWVNVCCCRJV-UHFFFAOYSA-N
XLogP15.21
TPSA284.98 Ų
H-Bond Donors2
H-Bond Acceptors32
Rotatable Bonds29
Heavy Atoms130
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001816.63
LogP ≤ 515.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1032

Analyze 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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-diamine with MolForge

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Related Compounds

3,3',3'',3'''-(1,4-Piperazine-1,4-diylbis(1,3,5-triazine-6,2,4-triylbis(oxymethylene)))tetrakis(3-ethyl-8,8,10,10-tetramethyl-1,5-dioxa-9-azaspiro(5.5)undecane)
CID 56620332
1,3,5-Triazine-2,4,6-triamine, N,N'''-1,2-ethanediylbis(N-(3-((4,6-bis((3-methoxypropyl)(2,2,6,6-tetramethyl-4-piperidinyl)amino)-1,3,5-triazin-2-yl)amino)propyl)-N',N''-bis(3-methoxypropyl)-N',N''-bis(2,2,6,6-tetramethyl-4-piperidinyl)-
CID 102438383
Einecs 285-474-9
CID 102438384
1,3,5-Triazine-2,4,6-triamine, N,N,N',N',N''-pentakis(3-((4,6-bis((3-methoxypropyl)(2,2,6,6-tetramethyl-4-piperidinyl)amino)-1,3,5-triazin-2-yl)amino)propyl)-N''-(3-((4-((3-(dimethylamino)propyl)amino)-6-((3-methoxypropyl)(2,2,6,6-tetramethyl-4-piperidinyl)amino)-1,3,5-triazin-2-yl)amino)propyl)-
CID 131632934
4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-N,N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazin-2-amine
CID 14365123
4-N,4-N-bis[3-[[4-[bis(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]-6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy-1,3,5-triazin-2-yl]-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]propyl]-2-N,2-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-6-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy-1,3,5-triazine-2,4-diamine
CID 19031690
6-[1-amino-3-[2-(3-aminopropylamino)ethylamino]-1,1,2-tris[4,6-bis[[3-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)propyl]amino]-1,3,5-triazin-2-yl]propan-2-yl]-2-N,4-N-bis[3-methoxy-3-(1,2,2,6,6-pentamethylpiperidin-4-yl)propyl]-1,3,5-triazine-2,4-diamine
CID 19367387
6-[1-amino-3-[2-(3-aminopropylamino)ethylamino]-1,1,2-tris[4,6-bis[[3-methoxy-3-(2,2,6,6-tetramethylpiperidin-4-yl)propyl]amino]-1,3,5-triazin-2-yl]propan-2-yl]-2-N,4-N-bis[3-methoxy-3-(2,2,6,6-tetramethylpiperidin-4-yl)propyl]-1,3,5-triazine-2,4-diamine
CID 19367388
1-N,6-N-bis[4,6-bis[(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]-6-methylheptane-1,6-diamine
CID 19832523
1-[4-[[4-[6-[[4-(1-Acetyl-2,2,6,6-tetramethylpiperidin-4-yl)oxy-6-(2,2,6,6-tetramethylpiperidin-1-yl)-1,3,5-triazin-2-yl]amino]hexylamino]-6-(2,2,6,6-tetramethylpiperidin-1-yl)-1,3,5-triazin-2-yl]oxy]-2,2,6,6-tetramethylpiperidin-1-yl]ethanone
CID 19991777
6-N-[8-[[4,6-bis[3-butoxypropyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]amino]-5-[[[4,6-bis[3-butoxypropyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]amino]methyl]octyl]-2-N,4-N-bis(3-butoxypropyl)-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 20272123
6-N-[8-[[4,6-bis[2-methoxypropyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]amino]-5-[[[4,6-bis[2-methoxypropyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]-1,3,5-triazin-2-yl]amino]methyl]octyl]-2-N,4-N-bis(2-methoxypropyl)-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 20272126

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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-diamine (CID 22068153) 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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-diamine is CN1C(C)(C)CC(Oc2nc(NCCN(CCN(CCNc3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)c3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)c3nc(OC4CC(C)(C)N(C)C(C)(C)C4)nc(OC4CC(C)(C)N(C)C(C)(C)C4)n3)nc(OC3CC(C)(C)N(C)C(C)(C)C3)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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-diamine?
The InChIKey is CIERWVNVCCCRJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C98H174N24O8/c1-83(2)47-63(48-84(3,4)113(83)33)123-75-101-71(102-76(109-75)124-64-49-85(5,6)114(34)86(7,8)50-64)99-41-43-121(73-105-79(127-67-55-91(17,18)117(37)92(19,20)56-67)111-80(106-73)128-68-57-93(21,22)118(38)94(23,24)58-68)45-46-122(74-107-81(129-69-59-95(25,26)119(39)96(27,28)60-69)112-82(108-74)130-70-61-97(29,30)120(40)98(31,32)62-70)44-42-100-72-103-77(125-65-51-87(9,10)115(35)88(11,12)52-65)110-78(104-72)126-66-53-89(13,14)116(36)90(15,16)54-66/h63-70H,41-62H2,1-40H3,(H,99,101,102,109)(H,100,103,104,110).
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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-diamine has a molecular weight of 1816.63 g/mol, XLogP of 15.21, 29 rotatable bonds, 2 hydrogen bond donors, and 32 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]-[2-[[4,6-bis[(1,2,2,6,6-pentamethylpiperidin-4-yl)oxy]-1,3,5-triazin-2-yl]amino]ethyl]amino]ethyl]ethane-1,2-diamine is sourced from PubChem (CID 22068153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).