(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

C57H106N4O8 — CID 160634307

IUPAC(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
SMILESCC1(C)CC(OC(=O)CCCCCCCCC(=O)C2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O.CN1C(C)(C)CC(C(=O)CCCCCCCCC(=O)OC2CC(C)(C)NC(C)(C)C2)CC1(C)C
InChIInChI=1S/C29H54N2O3.C28H52N2O5/c1-26(2)20-23(21-27(3,4)30-26)34-25(33)17-15-13-11-10-12-14-16-24(32)22-18-28(5,6)31(9)29(7,8)19-22;1-25(2)17-21(18-26(3,4)29(25)33)23(31)15-13-11-9-10-12-14-16-24(32)35-22-19-27(5,6)30(34)28(7,8)20-22/h22-23,30H,10-21H2,1-9H3;21-22,33-34H,9-20H2,1-8H3
InChIKeyGUZOYKXYFFHMBH-UHFFFAOYSA-N
MW975.49 g/mol
LogP12.72
Rot. Bonds22

About (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

(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 (PubChem CID 160634307) has the molecular formula C57H106N4O8 and a molecular weight of 975.49 g/mol. Its IUPAC name is (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.

Molecular Properties

Compound Name(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
PubChem CID160634307
Molecular FormulaC57H106N4O8
Molecular Weight975.49 g/mol
Exact Mass974.80
IUPAC Name(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
SMILESCC1(C)CC(OC(=O)CCCCCCCCC(=O)C2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O.CN1C(C)(C)CC(C(=O)CCCCCCCCC(=O)OC2CC(C)(C)NC(C)(C)C2)CC1(C)C
InChIInChI=1S/C29H54N2O3.C28H52N2O5/c1-26(2)20-23(21-27(3,4)30-26)34-25(33)17-15-13-11-10-12-14-16-24(32)22-18-28(5,6)31(9)29(7,8)19-22;1-25(2)17-21(18-26(3,4)29(25)33)23(31)15-13-11-9-10-12-14-16-24(32)35-22-19-27(5,6)30(34)28(7,8)20-22/h22-23,30H,10-21H2,1-9H3;21-22,33-34H,9-20H2,1-8H3
InChIKeyGUZOYKXYFFHMBH-UHFFFAOYSA-N
XLogP12.72
TPSA148.95 Ų
H-Bond Donors3
H-Bond Acceptors12
Rotatable Bonds22
Heavy Atoms69
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500975.49
LogP ≤ 512.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze (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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of (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?
The IUPAC name of (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) is (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.
What is the SMILES notation for (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?
The canonical SMILES for (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 is CC1(C)CC(OC(=O)CCCCCCCCC(=O)C2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O.CN1C(C)(C)CC(C(=O)CCCCCCCCC(=O)OC2CC(C)(C)NC(C)(C)C2)CC1(C)C.
What is the InChIKey of (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?
The InChIKey is GUZOYKXYFFHMBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H54N2O3.C28H52N2O5/c1-26(2)20-23(21-27(3,4)30-26)34-25(33)17-15-13-11-10-12-14-16-24(32)22-18-28(5,6)31(9)29(7,8)19-22;1-25(2)17-21(18-26(3,4)29(25)33)23(31)15-13-11-9-10-12-14-16-24(32)35-22-19-27(5,6)30(34)28(7,8)20-22/h22-23,30H,10-21H2,1-9H3;21-22,33-34H,9-20H2,1-8H3.
What are the key properties of (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?
(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 has a molecular weight of 975.49 g/mol, XLogP of 12.72, 22 rotatable bonds, 3 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for (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 is sourced from PubChem (CID 160634307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).