1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine

C24H44N2 — CID 142761181

IUPAC1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine
SMILESC(=CCN1CCCCC1)CCCCCCCCC=CCN1CCCCC1
InChIInChI=1S/C24H44N2/c1(3-5-7-9-13-19-25-21-15-11-16-22-25)2-4-6-8-10-14-20-26-23-17-12-18-24-26/h9-10,13-14H,1-8,11-12,15-24H2
InChIKeySTVUFXVPVIZHHR-UHFFFAOYSA-N
MW360.63 g/mol
LogP6.19
Rot. Bonds13

About 1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine

1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine (PubChem CID 142761181) has the molecular formula C24H44N2 and a molecular weight of 360.63 g/mol. Its IUPAC name is 1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine.

Molecular Properties

Compound Name1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine
PubChem CID142761181
Molecular FormulaC24H44N2
Molecular Weight360.63 g/mol
Exact Mass360.35
IUPAC Name1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine
SMILESC(=CCN1CCCCC1)CCCCCCCCC=CCN1CCCCC1
InChIInChI=1S/C24H44N2/c1(3-5-7-9-13-19-25-21-15-11-16-22-25)2-4-6-8-10-14-20-26-23-17-12-18-24-26/h9-10,13-14H,1-8,11-12,15-24H2
InChIKeySTVUFXVPVIZHHR-UHFFFAOYSA-N
XLogP6.19
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.63
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine?
The IUPAC name of 1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine (CID 142761181) is 1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine.
What is the SMILES notation for 1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine?
The canonical SMILES for 1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine is C(=CCN1CCCCC1)CCCCCCCCC=CCN1CCCCC1.
What is the InChIKey of 1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine?
The InChIKey is STVUFXVPVIZHHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H44N2/c1(3-5-7-9-13-19-25-21-15-11-16-22-25)2-4-6-8-10-14-20-26-23-17-12-18-24-26/h9-10,13-14H,1-8,11-12,15-24H2.
What are the key properties of 1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine?
1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine has a molecular weight of 360.63 g/mol, XLogP of 6.19, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(14-piperidin-1-yltetradeca-2,12-dienyl)piperidine is sourced from PubChem (CID 142761181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).