1-[(Z)-hept-3-en-4-yl]piperidine

C12H23N — CID 21499132

IUPAC1-[(Z)-hept-3-en-4-yl]piperidine
SMILESCC/C=C(/CCC)N1CCCCC1
InChIInChI=1S/C12H23N/c1-3-8-12(9-4-2)13-10-6-5-7-11-13/h8H,3-7,9-11H2,1-2H3/b12-8-
InChIKeyURKONRMYEDZNOU-WQLSENKSSA-N
MW181.32 g/mol
LogP3.57
Rot. Bonds4

About 1-[(Z)-hept-3-en-4-yl]piperidine

1-[(Z)-hept-3-en-4-yl]piperidine (PubChem CID 21499132) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 1-[(Z)-hept-3-en-4-yl]piperidine.

Molecular Properties

Compound Name1-[(Z)-hept-3-en-4-yl]piperidine
PubChem CID21499132
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name1-[(Z)-hept-3-en-4-yl]piperidine
SMILESCC/C=C(/CCC)N1CCCCC1
InChIInChI=1S/C12H23N/c1-3-8-12(9-4-2)13-10-6-5-7-11-13/h8H,3-7,9-11H2,1-2H3/b12-8-
InChIKeyURKONRMYEDZNOU-WQLSENKSSA-N
XLogP3.57
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-hept-3-en-4-yl]piperidine?
The IUPAC name of 1-[(Z)-hept-3-en-4-yl]piperidine (CID 21499132) is 1-[(Z)-hept-3-en-4-yl]piperidine.
What is the SMILES notation for 1-[(Z)-hept-3-en-4-yl]piperidine?
The canonical SMILES for 1-[(Z)-hept-3-en-4-yl]piperidine is CC/C=C(/CCC)N1CCCCC1.
What is the InChIKey of 1-[(Z)-hept-3-en-4-yl]piperidine?
The InChIKey is URKONRMYEDZNOU-WQLSENKSSA-N. The full InChI is InChI=1S/C12H23N/c1-3-8-12(9-4-2)13-10-6-5-7-11-13/h8H,3-7,9-11H2,1-2H3/b12-8-.
What are the key properties of 1-[(Z)-hept-3-en-4-yl]piperidine?
1-[(Z)-hept-3-en-4-yl]piperidine has a molecular weight of 181.32 g/mol, XLogP of 3.57, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-hept-3-en-4-yl]piperidine is sourced from PubChem (CID 21499132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).