1-(11,11-dimethyldodecyl)piperidine

C19H39N — CID 118887407

IUPAC1-(11,11-dimethyldodecyl)piperidine
SMILESCC(C)(C)CCCCCCCCCCN1CCCCC1
InChIInChI=1S/C19H39N/c1-19(2,3)15-11-8-6-4-5-7-9-12-16-20-17-13-10-14-18-20/h4-18H2,1-3H3
InChIKeyHNBIPOQVALEIGC-UHFFFAOYSA-N
MW281.53 g/mol
LogP6.03
Rot. Bonds10

About 1-(11,11-dimethyldodecyl)piperidine

1-(11,11-dimethyldodecyl)piperidine (PubChem CID 118887407) has the molecular formula C19H39N and a molecular weight of 281.53 g/mol. Its IUPAC name is 1-(11,11-dimethyldodecyl)piperidine.

Molecular Properties

Compound Name1-(11,11-dimethyldodecyl)piperidine
PubChem CID118887407
Molecular FormulaC19H39N
Molecular Weight281.53 g/mol
Exact Mass281.31
IUPAC Name1-(11,11-dimethyldodecyl)piperidine
SMILESCC(C)(C)CCCCCCCCCCN1CCCCC1
InChIInChI=1S/C19H39N/c1-19(2,3)15-11-8-6-4-5-7-9-12-16-20-17-13-10-14-18-20/h4-18H2,1-3H3
InChIKeyHNBIPOQVALEIGC-UHFFFAOYSA-N
XLogP6.03
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.53
LogP ≤ 56.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(3,3-dimethylbutyl)azocane
CID 166986973
1-(6,6,6-trifluorohexyl)piperidine
CID 71259183
1-(6-piperidin-1-ylhexyl)piperidine bromide
CID 53351438
2,2-dimethyl-6-piperidin-1-ylhexanoic acid
CID 106713861
3-tert-butyl-1-(8,8-dimethylnonyl)piperidine
CID 152833336
1-decylpiperidine
CID 4649960
1-octylazonane
CID 20533821
1-dodecylazepane
CID 3366129
1-tetradecylpiperidine;hydrochloride
CID 71325293
CID 162323144
CID 162323144
ethane;1-nonylpiperidine
CID 177011009
1-butylpiperidine;hexane;1-hexylpiperidine
CID 156727490

Frequently Asked Questions

What is the IUPAC name of 1-(11,11-dimethyldodecyl)piperidine?
The IUPAC name of 1-(11,11-dimethyldodecyl)piperidine (CID 118887407) is 1-(11,11-dimethyldodecyl)piperidine.
What is the SMILES notation for 1-(11,11-dimethyldodecyl)piperidine?
The canonical SMILES for 1-(11,11-dimethyldodecyl)piperidine is CC(C)(C)CCCCCCCCCCN1CCCCC1.
What is the InChIKey of 1-(11,11-dimethyldodecyl)piperidine?
The InChIKey is HNBIPOQVALEIGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H39N/c1-19(2,3)15-11-8-6-4-5-7-9-12-16-20-17-13-10-14-18-20/h4-18H2,1-3H3.
What are the key properties of 1-(11,11-dimethyldodecyl)piperidine?
1-(11,11-dimethyldodecyl)piperidine has a molecular weight of 281.53 g/mol, XLogP of 6.03, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(11,11-dimethyldodecyl)piperidine is sourced from PubChem (CID 118887407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).