3-ethenyl-4-ethyl-3-fluoropiperidine

C9H16FN — CID 154669990

IUPAC3-ethenyl-4-ethyl-3-fluoropiperidine
SMILESC=CC1(F)CNCCC1CC
InChIInChI=1S/C9H16FN/c1-3-8-5-6-11-7-9(8,10)4-2/h4,8,11H,2-3,5-7H2,1H3
InChIKeySLNJCOKLTKQXPO-UHFFFAOYSA-N
MW157.23 g/mol
LogP1.90
Rot. Bonds2

About 3-ethenyl-4-ethyl-3-fluoropiperidine

3-ethenyl-4-ethyl-3-fluoropiperidine (PubChem CID 154669990) has the molecular formula C9H16FN and a molecular weight of 157.23 g/mol. Its IUPAC name is 3-ethenyl-4-ethyl-3-fluoropiperidine.

Molecular Properties

Compound Name3-ethenyl-4-ethyl-3-fluoropiperidine
PubChem CID154669990
Molecular FormulaC9H16FN
Molecular Weight157.23 g/mol
Exact Mass157.13
IUPAC Name3-ethenyl-4-ethyl-3-fluoropiperidine
SMILESC=CC1(F)CNCCC1CC
InChIInChI=1S/C9H16FN/c1-3-8-5-6-11-7-9(8,10)4-2/h4,8,11H,2-3,5-7H2,1H3
InChIKeySLNJCOKLTKQXPO-UHFFFAOYSA-N
XLogP1.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.23
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-(Prop-2-en-1-yl)piperidine
CID 19097419
4-Fluoro-4-vinylpiperidine
CID 89216907
(3R)-3-fluoro-3-prop-2-enylpiperidine
CID 89369745
(Z)-N-ethyl-2-[(2S)-2-fluoropentan-3-yl]pent-3-en-1-amine
CID 90261572
3-Fluoro-3-prop-2-enylpiperidine
CID 112563023
4-Allyl-4-fluoropiperidine
CID 112563266
4-[(Z)-3-fluoroprop-2-enyl]piperidine
CID 142033802
1-[3-(1-Fluoroethenyl)-2-methylhex-5-en-2-yl]piperazine
CID 144144899
4-But-3-enyl-4-fluoropiperidine
CID 147528951
3-Ethenyl-1-ethyl-3-fluoro-4-propan-2-ylpiperidine
CID 154670049
3-Ethenyl-3-fluoro-4-methylpiperidine
CID 154670361
3-Ethenyl-3-fluoro-4-propan-2-ylpiperidine
CID 154670759

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-4-ethyl-3-fluoropiperidine?
The IUPAC name of 3-ethenyl-4-ethyl-3-fluoropiperidine (CID 154669990) is 3-ethenyl-4-ethyl-3-fluoropiperidine.
What is the SMILES notation for 3-ethenyl-4-ethyl-3-fluoropiperidine?
The canonical SMILES for 3-ethenyl-4-ethyl-3-fluoropiperidine is C=CC1(F)CNCCC1CC.
What is the InChIKey of 3-ethenyl-4-ethyl-3-fluoropiperidine?
The InChIKey is SLNJCOKLTKQXPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16FN/c1-3-8-5-6-11-7-9(8,10)4-2/h4,8,11H,2-3,5-7H2,1H3.
What are the key properties of 3-ethenyl-4-ethyl-3-fluoropiperidine?
3-ethenyl-4-ethyl-3-fluoropiperidine has a molecular weight of 157.23 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-4-ethyl-3-fluoropiperidine is sourced from PubChem (CID 154669990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).