4-[cyclohexen-1-yl(fluoro)methyl]piperidine

C12H20FN — CID 106655021

IUPAC4-[cyclohexen-1-yl(fluoro)methyl]piperidine
SMILESFC(C1=CCCCC1)C1CCNCC1
InChIInChI=1S/C12H20FN/c13-12(10-4-2-1-3-5-10)11-6-8-14-9-7-11/h4,11-12,14H,1-3,5-9H2
InChIKeyJNWHZQZZJBCEAX-UHFFFAOYSA-N
MW197.30 g/mol
LogP2.82
Rot. Bonds2

About 4-[cyclohexen-1-yl(fluoro)methyl]piperidine

4-[cyclohexen-1-yl(fluoro)methyl]piperidine (PubChem CID 106655021) has the molecular formula C12H20FN and a molecular weight of 197.30 g/mol. Its IUPAC name is 4-[cyclohexen-1-yl(fluoro)methyl]piperidine.

Molecular Properties

Compound Name4-[cyclohexen-1-yl(fluoro)methyl]piperidine
PubChem CID106655021
Molecular FormulaC12H20FN
Molecular Weight197.30 g/mol
Exact Mass197.16
IUPAC Name4-[cyclohexen-1-yl(fluoro)methyl]piperidine
SMILESFC(C1=CCCCC1)C1CCNCC1
InChIInChI=1S/C12H20FN/c13-12(10-4-2-1-3-5-10)11-6-8-14-9-7-11/h4,11-12,14H,1-3,5-9H2
InChIKeyJNWHZQZZJBCEAX-UHFFFAOYSA-N
XLogP2.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4-[cyclohexen-1-yl(fluoro)methyl]piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[cyclohexen-1-yl(fluoro)methyl]piperidine?
The IUPAC name of 4-[cyclohexen-1-yl(fluoro)methyl]piperidine (CID 106655021) is 4-[cyclohexen-1-yl(fluoro)methyl]piperidine.
What is the SMILES notation for 4-[cyclohexen-1-yl(fluoro)methyl]piperidine?
The canonical SMILES for 4-[cyclohexen-1-yl(fluoro)methyl]piperidine is FC(C1=CCCCC1)C1CCNCC1.
What is the InChIKey of 4-[cyclohexen-1-yl(fluoro)methyl]piperidine?
The InChIKey is JNWHZQZZJBCEAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20FN/c13-12(10-4-2-1-3-5-10)11-6-8-14-9-7-11/h4,11-12,14H,1-3,5-9H2.
What are the key properties of 4-[cyclohexen-1-yl(fluoro)methyl]piperidine?
4-[cyclohexen-1-yl(fluoro)methyl]piperidine has a molecular weight of 197.30 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclohexen-1-yl(fluoro)methyl]piperidine is sourced from PubChem (CID 106655021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).