4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine

C11H18FNO — CID 130855903

IUPAC4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine
SMILESCC(F)(C1=CCCO1)C1CCNCC1
InChIInChI=1S/C11H18FNO/c1-11(12,10-3-2-8-14-10)9-4-6-13-7-5-9/h3,9,13H,2,4-8H2,1H3
InChIKeyQPQUWABFVZVTJR-UHFFFAOYSA-N
MW199.27 g/mol
LogP2.02
Rot. Bonds2

About 4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine

4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine (PubChem CID 130855903) has the molecular formula C11H18FNO and a molecular weight of 199.27 g/mol. Its IUPAC name is 4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine.

Molecular Properties

Compound Name4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine
PubChem CID130855903
Molecular FormulaC11H18FNO
Molecular Weight199.27 g/mol
Exact Mass199.14
IUPAC Name4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine
SMILESCC(F)(C1=CCCO1)C1CCNCC1
InChIInChI=1S/C11H18FNO/c1-11(12,10-3-2-8-14-10)9-4-6-13-7-5-9/h3,9,13H,2,4-8H2,1H3
InChIKeyQPQUWABFVZVTJR-UHFFFAOYSA-N
XLogP2.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.27
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine?
The IUPAC name of 4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine (CID 130855903) is 4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine.
What is the SMILES notation for 4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine?
The canonical SMILES for 4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine is CC(F)(C1=CCCO1)C1CCNCC1.
What is the InChIKey of 4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine?
The InChIKey is QPQUWABFVZVTJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18FNO/c1-11(12,10-3-2-8-14-10)9-4-6-13-7-5-9/h3,9,13H,2,4-8H2,1H3.
What are the key properties of 4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine?
4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine has a molecular weight of 199.27 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(2,3-dihydrofuran-5-yl)-1-fluoroethyl]piperidine is sourced from PubChem (CID 130855903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).