1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine

C15H24FN — CID 144983831

IUPAC1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine
SMILESC=C(F)/C(C)=C(C)\C=C(/CC)N1CCCCC1
InChIInChI=1S/C15H24FN/c1-5-15(17-9-7-6-8-10-17)11-12(2)13(3)14(4)16/h11H,4-10H2,1-3H3/b13-12-,15-11+
InChIKeyOAKKPWLZMPVSRZ-YABTVZGTSA-N
MW237.36 g/mol
LogP4.59
Rot. Bonds4

About 1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine

1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine (PubChem CID 144983831) has the molecular formula C15H24FN and a molecular weight of 237.36 g/mol. Its IUPAC name is 1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine.

Molecular Properties

Compound Name1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine
PubChem CID144983831
Molecular FormulaC15H24FN
Molecular Weight237.36 g/mol
Exact Mass237.19
IUPAC Name1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine
SMILESC=C(F)/C(C)=C(C)\C=C(/CC)N1CCCCC1
InChIInChI=1S/C15H24FN/c1-5-15(17-9-7-6-8-10-17)11-12(2)13(3)14(4)16/h11H,4-10H2,1-3H3/b13-12-,15-11+
InChIKeyOAKKPWLZMPVSRZ-YABTVZGTSA-N
XLogP4.59
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.36
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine with MolForge

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Launch Full Analysis

Related Compounds

3-Piperidino-2-pentene
CID 5372437
1-(1-Cyclopenta-2,4-dien-1-ylidenepropyl)piperidine
CID 134982821
(2E,4Z)-4-[(4,4-difluoropiperidin-1-yl)methyl]hepta-2,4,6-trien-3-amine
CID 88905164
4-Fluoro-1-methyl-2-propan-2-ylidenepiperidine
CID 89209697
1-[5-(Trifluoromethyl)hexa-1,3,5-trien-2-yl]piperidine
CID 91262904
1-(3-Fluoro-2-propan-2-ylidenehex-3-enyl)piperidine
CID 123561041
5-Fluoro-1-(3-methylbut-2-en-2-yl)-2-methylidene-3-propylpyridine
CID 129083998
1-[(4E,6Z,8E)-9-fluoro-4-methylnona-4,6,8-trienyl]piperidine
CID 130243379
1-[(3E,5Z)-4-fluoro-2-methylidenehepta-3,5-dienyl]piperidine
CID 134549692
1-[(4Z,6E)-4-[(E)-2-fluoroprop-1-enyl]octa-4,6-dienyl]piperidine
CID 135225542
4-fluoro-1-[(3E)-3-methylpenta-1,3-dien-2-yl]piperidine
CID 135265902
1-[(E)-5-fluoro-4-methylpent-3-enyl]piperidine
CID 140996575

Frequently Asked Questions

What is the IUPAC name of 1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine?
The IUPAC name of 1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine (CID 144983831) is 1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine.
What is the SMILES notation for 1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine?
The canonical SMILES for 1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine is C=C(F)/C(C)=C(C)\C=C(/CC)N1CCCCC1.
What is the InChIKey of 1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine?
The InChIKey is OAKKPWLZMPVSRZ-YABTVZGTSA-N. The full InChI is InChI=1S/C15H24FN/c1-5-15(17-9-7-6-8-10-17)11-12(2)13(3)14(4)16/h11H,4-10H2,1-3H3/b13-12-,15-11+.
What are the key properties of 1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine?
1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine has a molecular weight of 237.36 g/mol, XLogP of 4.59, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3E,5Z)-7-fluoro-5,6-dimethylocta-3,5,7-trien-3-yl]piperidine is sourced from PubChem (CID 144983831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).