4-(3-fluorophenoxy)piperidine;hydrochloride

C11H15ClFNO — CID 45074923

IUPAC4-(3-fluorophenoxy)piperidine;hydrochloride
SMILESCl.Fc1cccc(OC2CCNCC2)c1
InChIInChI=1S/C11H14FNO.ClH/c12-9-2-1-3-11(8-9)14-10-4-6-13-7-5-10;/h1-3,8,10,13H,4-7H2;1H
InChIKeyWRTHTGNXSSACJM-UHFFFAOYSA-N
MW231.70 g/mol
LogP2.38
Rot. Bonds2

About 4-(3-fluorophenoxy)piperidine;hydrochloride

4-(3-fluorophenoxy)piperidine;hydrochloride (PubChem CID 45074923) has the molecular formula C11H15ClFNO and a molecular weight of 231.70 g/mol. Its IUPAC name is 4-(3-fluorophenoxy)piperidine;hydrochloride.

Molecular Properties

Compound Name4-(3-fluorophenoxy)piperidine;hydrochloride
PubChem CID45074923
Molecular FormulaC11H15ClFNO
Molecular Weight231.70 g/mol
Exact Mass231.08
IUPAC Name4-(3-fluorophenoxy)piperidine;hydrochloride
SMILESCl.Fc1cccc(OC2CCNCC2)c1
InChIInChI=1S/C11H14FNO.ClH/c12-9-2-1-3-11(8-9)14-10-4-6-13-7-5-10;/h1-3,8,10,13H,4-7H2;1H
InChIKeyWRTHTGNXSSACJM-UHFFFAOYSA-N
XLogP2.38
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.70
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorophenoxy)piperidine;hydrochloride?
The IUPAC name of 4-(3-fluorophenoxy)piperidine;hydrochloride (CID 45074923) is 4-(3-fluorophenoxy)piperidine;hydrochloride.
What is the SMILES notation for 4-(3-fluorophenoxy)piperidine;hydrochloride?
The canonical SMILES for 4-(3-fluorophenoxy)piperidine;hydrochloride is Cl.Fc1cccc(OC2CCNCC2)c1.
What is the InChIKey of 4-(3-fluorophenoxy)piperidine;hydrochloride?
The InChIKey is WRTHTGNXSSACJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO.ClH/c12-9-2-1-3-11(8-9)14-10-4-6-13-7-5-10;/h1-3,8,10,13H,4-7H2;1H.
What are the key properties of 4-(3-fluorophenoxy)piperidine;hydrochloride?
4-(3-fluorophenoxy)piperidine;hydrochloride has a molecular weight of 231.70 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorophenoxy)piperidine;hydrochloride is sourced from PubChem (CID 45074923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).