2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate

C95H161N7O15 — CID 160641601

IUPAC2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate
SMILESCC1(C)CC(OC(=O)CCC(=O)OC2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O.CC1(C)CC(OC(=O)CCCCCCCCC(=O)OC2CC(C)(C)NC(C)(C)C2)CC(C)(C)C1.CCC(CCCCCCCC(=O)OC1CC(C)(C)NC(C)(C)C1)C(=O)OC1CC(C)(C)CC(C)(C)C1.Cc1ccc(O)c(-n2nc3ccccc3n2)c1
InChIInChI=1S/C31H57NO4.C29H53NO4.C22H40N2O6.C13H11N3O/c1-10-23(27(34)36-24-18-28(2,3)22-29(4,5)19-24)16-14-12-11-13-15-17-26(33)35-25-20-30(6,7)32-31(8,9)21-25;1-26(2)17-22(18-27(3,4)21-26)33-24(31)15-13-11-9-10-12-14-16-25(32)34-23-19-28(5,6)30-29(7,8)20-23;1-19(2)11-15(12-20(3,4)23(19)27)29-17(25)9-10-18(26)30-16-13-21(5,6)24(28)22(7,8)14-16;1-9-6-7-13(17)12(8-9)16-14-10-4-2-3-5-11(10)15-16/h23-25,32H,10-22H2,1-9H3;22-23,30H,9-21H2,1-8H3;15-16,27-28H,9-14H2,1-8H3;2-8,17H,1H3
InChIKeyMZUDDKRYQIZJPG-UHFFFAOYSA-N
MW1641.37 g/mol
LogP20.96
Rot. Bonds29

About 2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate

2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate (PubChem CID 160641601) has the molecular formula C95H161N7O15 and a molecular weight of 1641.37 g/mol. Its IUPAC name is 2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate.

Molecular Properties

Compound Name2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate
PubChem CID160641601
Molecular FormulaC95H161N7O15
Molecular Weight1641.37 g/mol
Exact Mass1640.21
IUPAC Name2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate
SMILESCC1(C)CC(OC(=O)CCC(=O)OC2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O.CC1(C)CC(OC(=O)CCCCCCCCC(=O)OC2CC(C)(C)NC(C)(C)C2)CC(C)(C)C1.CCC(CCCCCCCC(=O)OC1CC(C)(C)NC(C)(C)C1)C(=O)OC1CC(C)(C)CC(C)(C)C1.Cc1ccc(O)c(-n2nc3ccccc3n2)c1
InChIInChI=1S/C31H57NO4.C29H53NO4.C22H40N2O6.C13H11N3O/c1-10-23(27(34)36-24-18-28(2,3)22-29(4,5)19-24)16-14-12-11-13-15-17-26(33)35-25-20-30(6,7)32-31(8,9)21-25;1-26(2)17-22(18-27(3,4)21-26)33-24(31)15-13-11-9-10-12-14-16-25(32)34-23-19-28(5,6)30-29(7,8)20-23;1-19(2)11-15(12-20(3,4)23(19)27)29-17(25)9-10-18(26)30-16-13-21(5,6)24(28)22(7,8)14-16;1-9-6-7-13(17)12(8-9)16-14-10-4-2-3-5-11(10)15-16/h23-25,32H,10-22H2,1-9H3;22-23,30H,9-21H2,1-8H3;15-16,27-28H,9-14H2,1-8H3;2-8,17H,1H3
InChIKeyMZUDDKRYQIZJPG-UHFFFAOYSA-N
XLogP20.96
TPSA279.74 Ų
H-Bond Donors5
H-Bond Acceptors22
Rotatable Bonds29
Heavy Atoms117
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001641.37
LogP ≤ 520.96
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate;bis(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;bis(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate
CID 159805221
CID 140704439
CID 140704439
10-O-(2,2,6,6-tetramethyl-1-azabicyclo[2.2.0]hexan-4-yl) 1-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate
CID 122433569
bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-ethylbutanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-methylbutanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-methyldecanedioate;1-hydroxy-4-[4-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxybutoxy]-2,2,6,6-tetramethylpiperidine;1-hydroxy-4-[2-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxyethoxy]-2,2,6,6-tetramethylpiperidine;(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) benzoate;(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 4-methylbenzoate
CID 158964764
bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-ethylbutanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-methylbutanedioate;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 2-methyldecanedioate;1-hydroxy-4-[2-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxyethoxy]-2,2,6,6-tetramethylpiperidine;1-hydroxy-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidine;(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) benzoate;(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 4-methylbenzoate
CID 159515534
bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) hexanedioate
CID 57039687
[1-(2,2,6,6-tetramethylpiperidin-4-yl)oxy-9-(2,2,6,6-tetramethylpiperidin-4-yl)oxycarbonylundecylidene]oxidanium
CID 153184887
(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 10-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)-10-oxodecanoate;(2,2,6,6-tetramethylpiperidin-4-yl) 10-oxo-10-(1,2,2,6,6-pentamethylpiperidin-4-yl)decanoate
CID 160634307
2-(benzotriazol-2-yl)-4,6-dimethylphenol;(2,2,6,6-tetramethyl-1-octoxypiperidin-4-yl) 10-oxo-10-(3,3,5,5-tetramethyl-4-octoxypiperidin-1-yl)decanoate
CID 91607785
10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate
CID 118137040
2-O-(3,3,5,5-tetramethylcyclohexyl) 1-O,3-O,4-O-tris(2,2,6,6-tetramethylpiperidin-4-yl) butane-1,2,3,4-tetracarboxylate
CID 58322136
bis(2,2,6,6-tetramethylpiperidin-4-yl) 3-ethyldecanedioate
CID 137448538

Frequently Asked Questions

What is the IUPAC name of 2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate?
The IUPAC name of 2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate (CID 160641601) is 2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate.
What is the SMILES notation for 2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate?
The canonical SMILES for 2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate is CC1(C)CC(OC(=O)CCC(=O)OC2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O.CC1(C)CC(OC(=O)CCCCCCCCC(=O)OC2CC(C)(C)NC(C)(C)C2)CC(C)(C)C1.CCC(CCCCCCCC(=O)OC1CC(C)(C)NC(C)(C)C1)C(=O)OC1CC(C)(C)CC(C)(C)C1.Cc1ccc(O)c(-n2nc3ccccc3n2)c1.
What is the InChIKey of 2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate?
The InChIKey is MZUDDKRYQIZJPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H57NO4.C29H53NO4.C22H40N2O6.C13H11N3O/c1-10-23(27(34)36-24-18-28(2,3)22-29(4,5)19-24)16-14-12-11-13-15-17-26(33)35-25-20-30(6,7)32-31(8,9)21-25;1-26(2)17-22(18-27(3,4)21-26)33-24(31)15-13-11-9-10-12-14-16-25(32)34-23-19-28(5,6)30-29(7,8)20-23;1-19(2)11-15(12-20(3,4)23(19)27)29-17(25)9-10-18(26)30-16-13-21(5,6)24(28)22(7,8)14-16;1-9-6-7-13(17)12(8-9)16-14-10-4-2-3-5-11(10)15-16/h23-25,32H,10-22H2,1-9H3;22-23,30H,9-21H2,1-8H3;15-16,27-28H,9-14H2,1-8H3;2-8,17H,1H3.
What are the key properties of 2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate?
2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate has a molecular weight of 1641.37 g/mol, XLogP of 20.96, 29 rotatable bonds, 5 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzotriazol-2-yl)-4-methylphenol;bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) decanedioate;1-O-(3,3,5,5-tetramethylcyclohexyl) 10-O-(2,2,6,6-tetramethylpiperidin-4-yl) 2-ethyldecanedioate is sourced from PubChem (CID 160641601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).