3-dodecyl-2,2,6,6-tetramethylpiperidine

C21H43N — CID 173069280

IUPAC3-dodecyl-2,2,6,6-tetramethylpiperidine
SMILESCCCCCCCCCCCCC1CCC(C)(C)NC1(C)C
InChIInChI=1S/C21H43N/c1-6-7-8-9-10-11-12-13-14-15-16-19-17-18-20(2,3)22-21(19,4)5/h19,22H,6-18H2,1-5H3
InChIKeyBIGFZAFYZINXEJ-UHFFFAOYSA-N
MW309.58 g/mol
LogP6.85
Rot. Bonds11

About 3-dodecyl-2,2,6,6-tetramethylpiperidine

3-dodecyl-2,2,6,6-tetramethylpiperidine (PubChem CID 173069280) has the molecular formula C21H43N and a molecular weight of 309.58 g/mol. Its IUPAC name is 3-dodecyl-2,2,6,6-tetramethylpiperidine.

Molecular Properties

Compound Name3-dodecyl-2,2,6,6-tetramethylpiperidine
PubChem CID173069280
Molecular FormulaC21H43N
Molecular Weight309.58 g/mol
Exact Mass309.34
IUPAC Name3-dodecyl-2,2,6,6-tetramethylpiperidine
SMILESCCCCCCCCCCCCC1CCC(C)(C)NC1(C)C
InChIInChI=1S/C21H43N/c1-6-7-8-9-10-11-12-13-14-15-16-19-17-18-20(2,3)22-21(19,4)5/h19,22H,6-18H2,1-5H3
InChIKeyBIGFZAFYZINXEJ-UHFFFAOYSA-N
XLogP6.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500309.58
LogP ≤ 56.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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2-heptyl-1,1-dimethylcycloundecane
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N-ethyl-1-methyl-2-pentylcyclopropan-1-amine
CID 123705841
1-methyl-2-pentylcyclopropan-1-ol
CID 15701982
1,1-dimethoxy-2-octylcyclododecane
CID 134883102
N-butyl-2,2,7,7-tetramethylazepan-4-amine
CID 138568123
1,1-dibromo-2-octylcyclopropane
CID 2780238
1,1-dichloro-2-octylcyclopropane
CID 10799099
(2R)-1,1-difluoro-2-octylcyclopropane
CID 122227717
4-decyl-2,2,6-trimethyl-6-propylpiperidine
CID 126541478

Frequently Asked Questions

What is the IUPAC name of 3-dodecyl-2,2,6,6-tetramethylpiperidine?
The IUPAC name of 3-dodecyl-2,2,6,6-tetramethylpiperidine (CID 173069280) is 3-dodecyl-2,2,6,6-tetramethylpiperidine.
What is the SMILES notation for 3-dodecyl-2,2,6,6-tetramethylpiperidine?
The canonical SMILES for 3-dodecyl-2,2,6,6-tetramethylpiperidine is CCCCCCCCCCCCC1CCC(C)(C)NC1(C)C.
What is the InChIKey of 3-dodecyl-2,2,6,6-tetramethylpiperidine?
The InChIKey is BIGFZAFYZINXEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H43N/c1-6-7-8-9-10-11-12-13-14-15-16-19-17-18-20(2,3)22-21(19,4)5/h19,22H,6-18H2,1-5H3.
What are the key properties of 3-dodecyl-2,2,6,6-tetramethylpiperidine?
3-dodecyl-2,2,6,6-tetramethylpiperidine has a molecular weight of 309.58 g/mol, XLogP of 6.85, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dodecyl-2,2,6,6-tetramethylpiperidine is sourced from PubChem (CID 173069280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).