4-(1-fluoroprop-2-enyl)piperidine

C8H14FN — CID 112563661

IUPAC4-(1-fluoroprop-2-enyl)piperidine
SMILESC=CC(F)C1CCNCC1
InChIInChI=1S/C8H14FN/c1-2-8(9)7-3-5-10-6-4-7/h2,7-8,10H,1,3-6H2
InChIKeyYYBOKOHJUFZFPT-UHFFFAOYSA-N
MW143.21 g/mol
LogP1.51
Rot. Bonds2

About 4-(1-fluoroprop-2-enyl)piperidine

4-(1-fluoroprop-2-enyl)piperidine (PubChem CID 112563661) has the molecular formula C8H14FN and a molecular weight of 143.21 g/mol. Its IUPAC name is 4-(1-fluoroprop-2-enyl)piperidine.

Molecular Properties

Compound Name4-(1-fluoroprop-2-enyl)piperidine
PubChem CID112563661
Molecular FormulaC8H14FN
Molecular Weight143.21 g/mol
Exact Mass143.11
IUPAC Name4-(1-fluoroprop-2-enyl)piperidine
SMILESC=CC(F)C1CCNCC1
InChIInChI=1S/C8H14FN/c1-2-8(9)7-3-5-10-6-4-7/h2,7-8,10H,1,3-6H2
InChIKeyYYBOKOHJUFZFPT-UHFFFAOYSA-N
XLogP1.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 51.51
H-Bond Donors ≤ 51
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-(1-fluoroprop-2-enyl)piperidine?
The IUPAC name of 4-(1-fluoroprop-2-enyl)piperidine (CID 112563661) is 4-(1-fluoroprop-2-enyl)piperidine.
What is the SMILES notation for 4-(1-fluoroprop-2-enyl)piperidine?
The canonical SMILES for 4-(1-fluoroprop-2-enyl)piperidine is C=CC(F)C1CCNCC1.
What is the InChIKey of 4-(1-fluoroprop-2-enyl)piperidine?
The InChIKey is YYBOKOHJUFZFPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FN/c1-2-8(9)7-3-5-10-6-4-7/h2,7-8,10H,1,3-6H2.
What are the key properties of 4-(1-fluoroprop-2-enyl)piperidine?
4-(1-fluoroprop-2-enyl)piperidine has a molecular weight of 143.21 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-fluoroprop-2-enyl)piperidine is sourced from PubChem (CID 112563661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).