1-(2,7-dimethylocta-2,7-dienyl)piperidine

C15H27N — CID 86023806

IUPAC1-(2,7-dimethylocta-2,7-dienyl)piperidine
SMILESC=C(C)CCCC=C(C)CN1CCCCC1
InChIInChI=1S/C15H27N/c1-14(2)9-5-6-10-15(3)13-16-11-7-4-8-12-16/h10H,1,4-9,11-13H2,2-3H3
InChIKeyIPSAYWLKLRHUGH-UHFFFAOYSA-N
MW221.39 g/mol
LogP4.16
Rot. Bonds6

About 1-(2,7-dimethylocta-2,7-dienyl)piperidine

1-(2,7-dimethylocta-2,7-dienyl)piperidine (PubChem CID 86023806) has the molecular formula C15H27N and a molecular weight of 221.39 g/mol. Its IUPAC name is 1-(2,7-dimethylocta-2,7-dienyl)piperidine.

Molecular Properties

Compound Name1-(2,7-dimethylocta-2,7-dienyl)piperidine
PubChem CID86023806
Molecular FormulaC15H27N
Molecular Weight221.39 g/mol
Exact Mass221.21
IUPAC Name1-(2,7-dimethylocta-2,7-dienyl)piperidine
SMILESC=C(C)CCCC=C(C)CN1CCCCC1
InChIInChI=1S/C15H27N/c1-14(2)9-5-6-10-15(3)13-16-11-7-4-8-12-16/h10H,1,4-9,11-13H2,2-3H3
InChIKeyIPSAYWLKLRHUGH-UHFFFAOYSA-N
XLogP4.16
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.39
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(1S)-N,4-Dimethyl-N-(4-methylpent-3-enyl)cyclohex-3-enaminium
CID 657066
(1R)-N,4-Dimethyl-N-(4-methylpent-3-enyl)cyclohex-3-enaminium
CID 657068
Piperidine, 1-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-
CID 6446865
1-Geranylpiperidine
CID 12760939
4-ethyl-1-methyl-3,6-dihydro-2H-pyridine
CID 21345321
1,1'-Dimethyl-1,1',2,2',3,3',6,6'-octahydro-4,4'-bipyridine
CID 171013
1,5-Diethyl-1,2,3,6-tetrahydropyridine
CID 641110
1,1-Dimethyl-3,5-dimethylenepiperidinium chloride
CID 3016839
1-(2,5-Dimethyl-1,4-hexadien-1-YL)piperidine
CID 24209787
1-(3,7-Dimethyloct-6-en-1-yl)piperidine
CID 3592771
1-[(E)-2-ethylhex-2-enyl]-1-methylpiperidin-1-ium
CID 6152674
Ethyl viologen
CID 91704654

Frequently Asked Questions

What is the IUPAC name of 1-(2,7-dimethylocta-2,7-dienyl)piperidine?
The IUPAC name of 1-(2,7-dimethylocta-2,7-dienyl)piperidine (CID 86023806) is 1-(2,7-dimethylocta-2,7-dienyl)piperidine.
What is the SMILES notation for 1-(2,7-dimethylocta-2,7-dienyl)piperidine?
The canonical SMILES for 1-(2,7-dimethylocta-2,7-dienyl)piperidine is C=C(C)CCCC=C(C)CN1CCCCC1.
What is the InChIKey of 1-(2,7-dimethylocta-2,7-dienyl)piperidine?
The InChIKey is IPSAYWLKLRHUGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N/c1-14(2)9-5-6-10-15(3)13-16-11-7-4-8-12-16/h10H,1,4-9,11-13H2,2-3H3.
What are the key properties of 1-(2,7-dimethylocta-2,7-dienyl)piperidine?
1-(2,7-dimethylocta-2,7-dienyl)piperidine has a molecular weight of 221.39 g/mol, XLogP of 4.16, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,7-dimethylocta-2,7-dienyl)piperidine is sourced from PubChem (CID 86023806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).