4-ethenyl-1-ethyl-4-fluoropiperidine

C9H16FN — CID 123282672

IUPAC4-ethenyl-1-ethyl-4-fluoropiperidine
SMILESC=CC1(F)CCN(CC)CC1
InChIInChI=1S/C9H16FN/c1-3-9(10)5-7-11(4-2)8-6-9/h3H,1,4-8H2,2H3
InChIKeyHRZJYHWNSNGTSE-UHFFFAOYSA-N
MW157.23 g/mol
LogP2.00
Rot. Bonds2

About 4-ethenyl-1-ethyl-4-fluoropiperidine

4-ethenyl-1-ethyl-4-fluoropiperidine (PubChem CID 123282672) has the molecular formula C9H16FN and a molecular weight of 157.23 g/mol. Its IUPAC name is 4-ethenyl-1-ethyl-4-fluoropiperidine.

Molecular Properties

Compound Name4-ethenyl-1-ethyl-4-fluoropiperidine
PubChem CID123282672
Molecular FormulaC9H16FN
Molecular Weight157.23 g/mol
Exact Mass157.13
IUPAC Name4-ethenyl-1-ethyl-4-fluoropiperidine
SMILESC=CC1(F)CCN(CC)CC1
InChIInChI=1S/C9H16FN/c1-3-9(10)5-7-11(4-2)8-6-9/h3H,1,4-8H2,2H3
InChIKeyHRZJYHWNSNGTSE-UHFFFAOYSA-N
XLogP2.00
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.23
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-1-ethyl-4-fluoropiperidine?
The IUPAC name of 4-ethenyl-1-ethyl-4-fluoropiperidine (CID 123282672) is 4-ethenyl-1-ethyl-4-fluoropiperidine.
What is the SMILES notation for 4-ethenyl-1-ethyl-4-fluoropiperidine?
The canonical SMILES for 4-ethenyl-1-ethyl-4-fluoropiperidine is C=CC1(F)CCN(CC)CC1.
What is the InChIKey of 4-ethenyl-1-ethyl-4-fluoropiperidine?
The InChIKey is HRZJYHWNSNGTSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16FN/c1-3-9(10)5-7-11(4-2)8-6-9/h3H,1,4-8H2,2H3.
What are the key properties of 4-ethenyl-1-ethyl-4-fluoropiperidine?
4-ethenyl-1-ethyl-4-fluoropiperidine has a molecular weight of 157.23 g/mol, XLogP of 2.00, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-1-ethyl-4-fluoropiperidine is sourced from PubChem (CID 123282672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).