4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine

C11H19N — CID 89113434

IUPAC4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine
SMILESC/C=C\C=C/CC1CCNCC1
InChIInChI=1S/C11H19N/c1-2-3-4-5-6-11-7-9-12-10-8-11/h2-5,11-12H,6-10H2,1H3/b3-2-,5-4-
InChIKeyKAGKXUDHCFWYNL-LDIADDGTSA-N
MW165.28 g/mol
LogP2.51
Rot. Bonds3

About 4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine

4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine (PubChem CID 89113434) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine.

Molecular Properties

Compound Name4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine
PubChem CID89113434
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine
SMILESC/C=C\C=C/CC1CCNCC1
InChIInChI=1S/C11H19N/c1-2-3-4-5-6-11-7-9-12-10-8-11/h2-5,11-12H,6-10H2,1H3/b3-2-,5-4-
InChIKeyKAGKXUDHCFWYNL-LDIADDGTSA-N
XLogP2.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine?
The IUPAC name of 4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine (CID 89113434) is 4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine.
What is the SMILES notation for 4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine?
The canonical SMILES for 4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine is C/C=C\C=C/CC1CCNCC1.
What is the InChIKey of 4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine?
The InChIKey is KAGKXUDHCFWYNL-LDIADDGTSA-N. The full InChI is InChI=1S/C11H19N/c1-2-3-4-5-6-11-7-9-12-10-8-11/h2-5,11-12H,6-10H2,1H3/b3-2-,5-4-.
What are the key properties of 4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine?
4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine has a molecular weight of 165.28 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2Z,4Z)-hexa-2,4-dienyl]piperidine is sourced from PubChem (CID 89113434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).