N-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine

C21H44N2 — CID 22368109

IUPACN-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine
SMILESCCCCCCCCCCCCNN1C(C)(C)CCCC1(C)C
InChIInChI=1S/C21H44N2/c1-6-7-8-9-10-11-12-13-14-15-19-22-23-20(2,3)17-16-18-21(23,4)5/h22H,6-19H2,1-5H3
InChIKeyYSJZKNKABZALFD-UHFFFAOYSA-N
MW324.60 g/mol
LogP6.45
Rot. Bonds12

About N-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine

N-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine (PubChem CID 22368109) has the molecular formula C21H44N2 and a molecular weight of 324.60 g/mol. Its IUPAC name is N-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine.

Molecular Properties

Compound NameN-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine
PubChem CID22368109
Molecular FormulaC21H44N2
Molecular Weight324.60 g/mol
Exact Mass324.35
IUPAC NameN-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine
SMILESCCCCCCCCCCCCNN1C(C)(C)CCCC1(C)C
InChIInChI=1S/C21H44N2/c1-6-7-8-9-10-11-12-13-14-15-19-22-23-20(2,3)17-16-18-21(23,4)5/h22H,6-19H2,1-5H3
InChIKeyYSJZKNKABZALFD-UHFFFAOYSA-N
XLogP6.45
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.60
LogP ≤ 56.45
H-Bond Donors ≤ 51
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-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine?
The IUPAC name of N-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine (CID 22368109) is N-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine.
What is the SMILES notation for N-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine?
The canonical SMILES for N-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine is CCCCCCCCCCCCNN1C(C)(C)CCCC1(C)C.
What is the InChIKey of N-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine?
The InChIKey is YSJZKNKABZALFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H44N2/c1-6-7-8-9-10-11-12-13-14-15-19-22-23-20(2,3)17-16-18-21(23,4)5/h22H,6-19H2,1-5H3.
What are the key properties of N-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine?
N-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine has a molecular weight of 324.60 g/mol, XLogP of 6.45, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-dodecyl-2,2,6,6-tetramethylpiperidin-1-amine is sourced from PubChem (CID 22368109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).