bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate

C109H196N6O24 — CID 135266076

IUPACbis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate
SMILESCCCCC(CCCc1cc(CCCC(CCCC)(C(=O)OCCCOC2CC(C)(C)N(O)C(C)(C)C2)C(=O)OCCCOC2CC(C)(C)N(O)C(C)(C)C2)cc(CCCC(CCCC)(C(=O)OCCCOC2CC(C)(C)N(O)C(C)(C)C2)C(=O)OCCCOC2CC(C)(C)N(O)C(C)(C)C2)c1)(C(=O)OCCCOC(CCC)CC(C)(C)N(O)CC)C(=O)OCCCOC1CC(C)(C)N(O)C(C)(C)C1
InChIInChI=1S/C109H196N6O24/c1-28-33-49-107(90(116)134-61-39-55-128-84(45-31-4)70-96(6,7)110(122)32-5,91(117)135-62-40-56-129-85-71-97(8,9)111(123)98(10,11)72-85)52-36-46-81-67-82(47-37-53-108(50-34-29-2,92(118)136-63-41-57-130-86-73-99(12,13)112(124)100(14,15)74-86)93(119)137-64-42-58-131-87-75-101(16,17)113(125)102(18,19)76-87)69-83(68-81)48-38-54-109(51-35-30-3,94(120)138-65-43-59-132-88-77-103(20,21)114(126)104(22,23)78-88)95(121)139-66-44-60-133-89-79-105(24,25)115(127)106(26,27)80-89/h67-69,84-89,122-127H,28-66,70-80H2,1-27H3
InChIKeyIPCKFYYTZUJHAG-UHFFFAOYSA-N
MW1974.78 g/mol
LogP20.99
Rot. Bonds63

About bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate

bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate (PubChem CID 135266076) has the molecular formula C109H196N6O24 and a molecular weight of 1974.78 g/mol. Its IUPAC name is bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate.

Molecular Properties

Compound Namebis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate
PubChem CID135266076
Molecular FormulaC109H196N6O24
Molecular Weight1974.78 g/mol
Exact Mass1973.43
IUPAC Namebis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate
SMILESCCCCC(CCCc1cc(CCCC(CCCC)(C(=O)OCCCOC2CC(C)(C)N(O)C(C)(C)C2)C(=O)OCCCOC2CC(C)(C)N(O)C(C)(C)C2)cc(CCCC(CCCC)(C(=O)OCCCOC2CC(C)(C)N(O)C(C)(C)C2)C(=O)OCCCOC2CC(C)(C)N(O)C(C)(C)C2)c1)(C(=O)OCCCOC(CCC)CC(C)(C)N(O)CC)C(=O)OCCCOC1CC(C)(C)N(O)C(C)(C)C1
InChIInChI=1S/C109H196N6O24/c1-28-33-49-107(90(116)134-61-39-55-128-84(45-31-4)70-96(6,7)110(122)32-5,91(117)135-62-40-56-129-85-71-97(8,9)111(123)98(10,11)72-85)52-36-46-81-67-82(47-37-53-108(50-34-29-2,92(118)136-63-41-57-130-86-73-99(12,13)112(124)100(14,15)74-86)93(119)137-64-42-58-131-87-75-101(16,17)113(125)102(18,19)76-87)69-83(68-81)48-38-54-109(51-35-30-3,94(120)138-65-43-59-132-88-77-103(20,21)114(126)104(22,23)78-88)95(121)139-66-44-60-133-89-79-105(24,25)115(127)106(26,27)80-89/h67-69,84-89,122-127H,28-66,70-80H2,1-27H3
InChIKeyIPCKFYYTZUJHAG-UHFFFAOYSA-N
XLogP20.99
TPSA354.00 Ų
H-Bond Donors6
H-Bond Acceptors30
Rotatable Bonds63
Heavy Atoms139
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001974.78
LogP ≤ 520.99
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate with MolForge

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Related Compounds

CID 140891553
CID 140891553
tris[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 12-methylhexadecane-4,4,11-tricarboxylate
CID 139514330
[4-[3-[2-butyl-2-[3-(1-hydroxy-1,2,2,6,6-pentamethylpiperidin-1-ium-4-yl)oxypropoxycarbonyl]-9,9-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]tridecanoyl]oxypropoxy]-2,2,6,6-tetramethylpiperidin-1-yl]oxidanium
CID 163597426
tris[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 12-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxymethyl]hexadecane-4,4,11-tricarboxylate
CID 146265209
bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-[3-[4-[4,4-bis[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxycarbonyl]octyl]-3-[4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxycarbonyl-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxycarbonyloctyl]phenyl]propyl]-2-butylpropanedioate
CID 135275067
1-O-[3-[4-methyl-4-(methylamino)pentan-2-yl]oxypropyl] 3-O-[3-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-butyl-2-(3-iodopropyl)propanedioate
CID 153368732
1-hydroxy-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidine
CID 118137024
[4-[2-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxycarbonyl-2-methylhexanoyl]oxy-2,2,6,6-tetramethylpiperidin-1-yl]oxidanium
CID 176948895
1-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 3-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-[3-[4-[4,4-bis[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxycarbonyl]octoxy]-4-oxobutanoyl]oxypropyl]-2-butylpropanedioate
CID 135266139
bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[4-[3-[1-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]-2-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl]-3-oxocyclopropyl]propyl]-3-[4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxy]-3-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]-3-methyl-4-oxobutyl]phenyl]propyl]-2-methylpropanedioate
CID 135281013
bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-[2-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxyethyl]propanedioate
CID 126739205
[4-[2-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxyethoxy]-2,2,6,6-tetramethylpiperidin-1-yl]oxidanium
CID 149204279

Frequently Asked Questions

What is the IUPAC name of bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate?
The IUPAC name of bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate (CID 135266076) is bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate.
What is the SMILES notation for bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate?
The canonical SMILES for bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate is CCCCC(CCCc1cc(CCCC(CCCC)(C(=O)OCCCOC2CC(C)(C)N(O)C(C)(C)C2)C(=O)OCCCOC2CC(C)(C)N(O)C(C)(C)C2)cc(CCCC(CCCC)(C(=O)OCCCOC2CC(C)(C)N(O)C(C)(C)C2)C(=O)OCCCOC2CC(C)(C)N(O)C(C)(C)C2)c1)(C(=O)OCCCOC(CCC)CC(C)(C)N(O)CC)C(=O)OCCCOC1CC(C)(C)N(O)C(C)(C)C1.
What is the InChIKey of bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate?
The InChIKey is IPCKFYYTZUJHAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C109H196N6O24/c1-28-33-49-107(90(116)134-61-39-55-128-84(45-31-4)70-96(6,7)110(122)32-5,91(117)135-62-40-56-129-85-71-97(8,9)111(123)98(10,11)72-85)52-36-46-81-67-82(47-37-53-108(50-34-29-2,92(118)136-63-41-57-130-86-73-99(12,13)112(124)100(14,15)74-86)93(119)137-64-42-58-131-87-75-101(16,17)113(125)102(18,19)76-87)69-83(68-81)48-38-54-109(51-35-30-3,94(120)138-65-43-59-132-88-77-103(20,21)114(126)104(22,23)78-88)95(121)139-66-44-60-133-89-79-105(24,25)115(127)106(26,27)80-89/h67-69,84-89,122-127H,28-66,70-80H2,1-27H3.
What are the key properties of bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate?
bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate has a molecular weight of 1974.78 g/mol, XLogP of 20.99, 63 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropyl] 2-[3-[3-[4,4-bis[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]-5-[4-[3-[2-[ethyl(hydroxy)amino]-2-methylheptan-4-yl]oxypropoxycarbonyl]-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxycarbonyl]octyl]phenyl]propyl]-2-butylpropanedioate is sourced from PubChem (CID 135266076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).