10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate

C30H56N2O5 — CID 118137040

IUPAC10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate
SMILESCC(CCCCCCCC(=O)OC1CC(C)(C)N(O)C(C)(C)C1)C(=O)OC1CC(C)(C)N(C)C(C)(C)C1
InChIInChI=1S/C30H56N2O5/c1-22(26(34)37-24-18-27(2,3)31(10)28(4,5)19-24)16-14-12-11-13-15-17-25(33)36-23-20-29(6,7)32(35)30(8,9)21-23/h22-24,35H,11-21H2,1-10H3
InChIKeyCBBUNJAZOADKFM-UHFFFAOYSA-N
MW524.79 g/mol
LogP6.50
Rot. Bonds11

About 10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate

10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate (PubChem CID 118137040) has the molecular formula C30H56N2O5 and a molecular weight of 524.79 g/mol. Its IUPAC name is 10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate.

Molecular Properties

Compound Name10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate
PubChem CID118137040
Molecular FormulaC30H56N2O5
Molecular Weight524.79 g/mol
Exact Mass524.42
IUPAC Name10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate
SMILESCC(CCCCCCCC(=O)OC1CC(C)(C)N(O)C(C)(C)C1)C(=O)OC1CC(C)(C)N(C)C(C)(C)C1
InChIInChI=1S/C30H56N2O5/c1-22(26(34)37-24-18-27(2,3)31(10)28(4,5)19-24)16-14-12-11-13-15-17-25(33)36-23-20-29(6,7)32(35)30(8,9)21-23/h22-24,35H,11-21H2,1-10H3
InChIKeyCBBUNJAZOADKFM-UHFFFAOYSA-N
XLogP6.50
TPSA79.31 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500524.79
LogP ≤ 56.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate?
The IUPAC name of 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) is 10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate.
What is the SMILES notation for 10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate?
The canonical SMILES for 10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate is CC(CCCCCCCC(=O)OC1CC(C)(C)N(O)C(C)(C)C1)C(=O)OC1CC(C)(C)N(C)C(C)(C)C1.
What is the InChIKey of 10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate?
The InChIKey is CBBUNJAZOADKFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H56N2O5/c1-22(26(34)37-24-18-27(2,3)31(10)28(4,5)19-24)16-14-12-11-13-15-17-25(33)36-23-20-29(6,7)32(35)30(8,9)21-23/h22-24,35H,11-21H2,1-10H3.
What are the key properties of 10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate?
10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate has a molecular weight of 524.79 g/mol, XLogP of 6.50, 11 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 10-O-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methyldecanedioate is sourced from PubChem (CID 118137040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).