4-(3-ethyl-5-fluorophenyl)piperidine

C13H18FN — CID 84779770

IUPAC4-(3-ethyl-5-fluorophenyl)piperidine
SMILESCCc1cc(F)cc(C2CCNCC2)c1
InChIInChI=1S/C13H18FN/c1-2-10-7-12(9-13(14)8-10)11-3-5-15-6-4-11/h7-9,11,15H,2-6H2,1H3
InChIKeyYZVUHGDBSKIFQJ-UHFFFAOYSA-N
MW207.29 g/mol
LogP2.86
Rot. Bonds2

About 4-(3-ethyl-5-fluorophenyl)piperidine

4-(3-ethyl-5-fluorophenyl)piperidine (PubChem CID 84779770) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is 4-(3-ethyl-5-fluorophenyl)piperidine.

Molecular Properties

Compound Name4-(3-ethyl-5-fluorophenyl)piperidine
PubChem CID84779770
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name4-(3-ethyl-5-fluorophenyl)piperidine
SMILESCCc1cc(F)cc(C2CCNCC2)c1
InChIInChI=1S/C13H18FN/c1-2-10-7-12(9-13(14)8-10)11-3-5-15-6-4-11/h7-9,11,15H,2-6H2,1H3
InChIKeyYZVUHGDBSKIFQJ-UHFFFAOYSA-N
XLogP2.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(3-ethyl-5-fluorophenyl)piperidine?
The IUPAC name of 4-(3-ethyl-5-fluorophenyl)piperidine (CID 84779770) is 4-(3-ethyl-5-fluorophenyl)piperidine.
What is the SMILES notation for 4-(3-ethyl-5-fluorophenyl)piperidine?
The canonical SMILES for 4-(3-ethyl-5-fluorophenyl)piperidine is CCc1cc(F)cc(C2CCNCC2)c1.
What is the InChIKey of 4-(3-ethyl-5-fluorophenyl)piperidine?
The InChIKey is YZVUHGDBSKIFQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-2-10-7-12(9-13(14)8-10)11-3-5-15-6-4-11/h7-9,11,15H,2-6H2,1H3.
What are the key properties of 4-(3-ethyl-5-fluorophenyl)piperidine?
4-(3-ethyl-5-fluorophenyl)piperidine has a molecular weight of 207.29 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethyl-5-fluorophenyl)piperidine is sourced from PubChem (CID 84779770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).