N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide

C17H32N2O — CID 22755904

IUPACN-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide
SMILESCCCCCCNC(=O)C=C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C17H32N2O/c1-6-7-8-9-10-18-15(20)11-14-12-16(2,3)19-17(4,5)13-14/h11,19H,6-10,12-13H2,1-5H3,(H,18,20)
InChIKeySNJSYJSDANTSSB-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.55
Rot. Bonds6

About N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide

N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide (PubChem CID 22755904) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide.

Molecular Properties

Compound NameN-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide
PubChem CID22755904
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC NameN-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide
SMILESCCCCCCNC(=O)C=C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C17H32N2O/c1-6-7-8-9-10-18-15(20)11-14-12-16(2,3)19-17(4,5)13-14/h11,19H,6-10,12-13H2,1-5H3,(H,18,20)
InChIKeySNJSYJSDANTSSB-UHFFFAOYSA-N
XLogP3.55
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide?
The IUPAC name of N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide (CID 22755904) is N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide.
What is the SMILES notation for N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide?
The canonical SMILES for N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide is CCCCCCNC(=O)C=C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide?
The InChIKey is SNJSYJSDANTSSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-6-7-8-9-10-18-15(20)11-14-12-16(2,3)19-17(4,5)13-14/h11,19H,6-10,12-13H2,1-5H3,(H,18,20).
What are the key properties of N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide?
N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide has a molecular weight of 280.46 g/mol, XLogP of 3.55, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexyl-2-(2,2,6,6-tetramethylpiperidin-4-ylidene)acetamide is sourced from PubChem (CID 22755904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).