4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine

C13H23NO — CID 143277789

IUPAC4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine
SMILESC=C(/C=C\C)COCCC1CCNCC1
InChIInChI=1S/C13H23NO/c1-3-4-12(2)11-15-10-7-13-5-8-14-9-6-13/h3-4,13-14H,2,5-11H2,1H3/b4-3-
InChIKeyYYFDEHFUXZWEOL-ARJAWSKDSA-N
MW209.33 g/mol
LogP2.53
Rot. Bonds6

About 4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine

4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine (PubChem CID 143277789) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine.

Molecular Properties

Compound Name4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine
PubChem CID143277789
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine
SMILESC=C(/C=C\C)COCCC1CCNCC1
InChIInChI=1S/C13H23NO/c1-3-4-12(2)11-15-10-7-13-5-8-14-9-6-13/h3-4,13-14H,2,5-11H2,1H3/b4-3-
InChIKeyYYFDEHFUXZWEOL-ARJAWSKDSA-N
XLogP2.53
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine?
The IUPAC name of 4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine (CID 143277789) is 4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine.
What is the SMILES notation for 4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine?
The canonical SMILES for 4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine is C=C(/C=C\C)COCCC1CCNCC1.
What is the InChIKey of 4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine?
The InChIKey is YYFDEHFUXZWEOL-ARJAWSKDSA-N. The full InChI is InChI=1S/C13H23NO/c1-3-4-12(2)11-15-10-7-13-5-8-14-9-6-13/h3-4,13-14H,2,5-11H2,1H3/b4-3-.
What are the key properties of 4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine?
4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine has a molecular weight of 209.33 g/mol, XLogP of 2.53, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(Z)-2-methylidenepent-3-enoxy]ethyl]piperidine is sourced from PubChem (CID 143277789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).