bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate

C28H52N2O6 — CID 11272241

IUPACbis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate
SMILESCC1(C)CC(OC(=O)CCCCCCCCC(=O)OC2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O
InChIInChI=1S/C28H52N2O6/c1-25(2)17-21(18-26(3,4)29(25)33)35-23(31)15-13-11-9-10-12-14-16-24(32)36-22-19-27(5,6)30(34)28(7,8)20-22/h21-22,33-34H,9-20H2,1-8H3
InChIKeySXPLGYBFGPYAHS-UHFFFAOYSA-N
MW512.73 g/mol
LogP6.02
Rot. Bonds11

About bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate

bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate (PubChem CID 11272241) has the molecular formula C28H52N2O6 and a molecular weight of 512.73 g/mol. Its IUPAC name is bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate.

Molecular Properties

Compound Namebis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate
PubChem CID11272241
Molecular FormulaC28H52N2O6
Molecular Weight512.73 g/mol
Exact Mass512.38
IUPAC Namebis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate
SMILESCC1(C)CC(OC(=O)CCCCCCCCC(=O)OC2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O
InChIInChI=1S/C28H52N2O6/c1-25(2)17-21(18-26(3,4)29(25)33)35-23(31)15-13-11-9-10-12-14-16-24(32)36-22-19-27(5,6)30(34)28(7,8)20-22/h21-22,33-34H,9-20H2,1-8H3
InChIKeySXPLGYBFGPYAHS-UHFFFAOYSA-N
XLogP6.02
TPSA99.54 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds11
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500512.73
LogP ≤ 56.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

Tinuvin 770
CID 164282
Bis(1,2,2,6,6-pentamethyl-4-piperidyl) sebacate
CID 586744
1-Piperidinyloxy, 4,4'-((1,10-dioxo-1,10-decanediyl)bis(oxy))bis(2,2,6,6-tetramethyl-
CID 6451408
Tinuvin 123
CID 3592789
1-(2-Hydroxy-2-methylpropoxy)-4-octadecanoyloxy-2,2,6,6-tetramethylpiperidine
CID 21885088
2,2,6,6-Tetramethyl-4-capryloyl-oxypiperidine-1-oxyl
CID 152451
Bis-(2,2,6,6-tetramethyl-piperidyl) sebacate
CID 15752114
Bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate
CID 326921
Octadecanoic acid, 1-hydroxy-2,2,6,6-tetramethyl-4-piperidinyl ester
CID 580171
(1-Hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) octanoate
CID 3826581
Bis(1-chloro-2,2,6,6-tetramethylpiperidin-4-YL) decanedioate
CID 14241397
Bis(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl) sebacate
CID 18716454

Frequently Asked Questions

What is the IUPAC name of bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate?
The IUPAC name of bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate (CID 11272241) is bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate.
What is the SMILES notation for bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate?
The canonical SMILES for bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate is CC1(C)CC(OC(=O)CCCCCCCCC(=O)OC2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O.
What is the InChIKey of bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate?
The InChIKey is SXPLGYBFGPYAHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H52N2O6/c1-25(2)17-21(18-26(3,4)29(25)33)35-23(31)15-13-11-9-10-12-14-16-24(32)36-22-19-27(5,6)30(34)28(7,8)20-22/h21-22,33-34H,9-20H2,1-8H3.
What are the key properties of bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate?
bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate has a molecular weight of 512.73 g/mol, XLogP of 6.02, 11 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) decanedioate is sourced from PubChem (CID 11272241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).