1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine

C16H29N — CID 14401147

IUPAC1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine
SMILESCCCC1CCC(/C=C/N2CCCCC2)CC1
InChIInChI=1S/C16H29N/c1-2-6-15-7-9-16(10-8-15)11-14-17-12-4-3-5-13-17/h11,14-16H,2-10,12-13H2,1H3/b14-11+
InChIKeyRMOVCTKNYMSDDM-SDNWHVSQSA-N
MW235.41 g/mol
LogP4.59
Rot. Bonds4

About 1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine

1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine (PubChem CID 14401147) has the molecular formula C16H29N and a molecular weight of 235.41 g/mol. Its IUPAC name is 1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine.

Molecular Properties

Compound Name1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine
PubChem CID14401147
Molecular FormulaC16H29N
Molecular Weight235.41 g/mol
Exact Mass235.23
IUPAC Name1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine
SMILESCCCC1CCC(/C=C/N2CCCCC2)CC1
InChIInChI=1S/C16H29N/c1-2-6-15-7-9-16(10-8-15)11-14-17-12-4-3-5-13-17/h11,14-16H,2-10,12-13H2,1H3/b14-11+
InChIKeyRMOVCTKNYMSDDM-SDNWHVSQSA-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 ≤ 500235.41
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine?
The IUPAC name of 1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine (CID 14401147) is 1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine.
What is the SMILES notation for 1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine?
The canonical SMILES for 1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine is CCCC1CCC(/C=C/N2CCCCC2)CC1.
What is the InChIKey of 1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine?
The InChIKey is RMOVCTKNYMSDDM-SDNWHVSQSA-N. The full InChI is InChI=1S/C16H29N/c1-2-6-15-7-9-16(10-8-15)11-14-17-12-4-3-5-13-17/h11,14-16H,2-10,12-13H2,1H3/b14-11+.
What are the key properties of 1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine?
1-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine has a molecular weight of 235.41 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-[(E)-2-(4-propylcyclohexyl)ethenyl]piperidine is sourced from PubChem (CID 14401147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).