N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide

C25H50N2O — CID 14697363

IUPACN-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide
SMILESCCCCCCCCCCCCCCCC(=O)NC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C25H50N2O/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(28)26-22-20-24(2,3)27-25(4,5)21-22/h22,27H,6-21H2,1-5H3,(H,26,28)
InChIKeyHUJMKGLPBLONOI-UHFFFAOYSA-N
MW394.69 g/mol
LogP6.89
Rot. Bonds15

About N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide

N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide (PubChem CID 14697363) has the molecular formula C25H50N2O and a molecular weight of 394.69 g/mol. Its IUPAC name is N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide.

Molecular Properties

Compound NameN-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide
PubChem CID14697363
Molecular FormulaC25H50N2O
Molecular Weight394.69 g/mol
Exact Mass394.39
IUPAC NameN-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide
SMILESCCCCCCCCCCCCCCCC(=O)NC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C25H50N2O/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(28)26-22-20-24(2,3)27-25(4,5)21-22/h22,27H,6-21H2,1-5H3,(H,26,28)
InChIKeyHUJMKGLPBLONOI-UHFFFAOYSA-N
XLogP6.89
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.69
LogP ≤ 56.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide?
The IUPAC name of N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide (CID 14697363) is N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide.
What is the SMILES notation for N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide?
The canonical SMILES for N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide is CCCCCCCCCCCCCCCC(=O)NC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide?
The InChIKey is HUJMKGLPBLONOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H50N2O/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(28)26-22-20-24(2,3)27-25(4,5)21-22/h22,27H,6-21H2,1-5H3,(H,26,28).
What are the key properties of N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide?
N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide has a molecular weight of 394.69 g/mol, XLogP of 6.89, 15 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,6,6-tetramethylpiperidin-4-yl)hexadecanamide is sourced from PubChem (CID 14697363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).