4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride

C12H17ClFNO — CID 46735675

IUPAC4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride
SMILESCl.Fc1ccc(COC2CCNCC2)cc1
InChIInChI=1S/C12H16FNO.ClH/c13-11-3-1-10(2-4-11)9-15-12-5-7-14-8-6-12;/h1-4,12,14H,5-9H2;1H
InChIKeyXRKHDSHUDCVEFK-UHFFFAOYSA-N
MW245.72 g/mol
LogP2.52
Rot. Bonds3

About 4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride

4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride (PubChem CID 46735675) has the molecular formula C12H17ClFNO and a molecular weight of 245.72 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride.

Molecular Properties

Compound Name4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride
PubChem CID46735675
Molecular FormulaC12H17ClFNO
Molecular Weight245.72 g/mol
Exact Mass245.10
IUPAC Name4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride
SMILESCl.Fc1ccc(COC2CCNCC2)cc1
InChIInChI=1S/C12H16FNO.ClH/c13-11-3-1-10(2-4-11)9-15-12-5-7-14-8-6-12;/h1-4,12,14H,5-9H2;1H
InChIKeyXRKHDSHUDCVEFK-UHFFFAOYSA-N
XLogP2.52
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.72
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride?
The IUPAC name of 4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride (CID 46735675) is 4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride.
What is the SMILES notation for 4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride?
The canonical SMILES for 4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride is Cl.Fc1ccc(COC2CCNCC2)cc1.
What is the InChIKey of 4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride?
The InChIKey is XRKHDSHUDCVEFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO.ClH/c13-11-3-1-10(2-4-11)9-15-12-5-7-14-8-6-12;/h1-4,12,14H,5-9H2;1H.
What are the key properties of 4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride?
4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride has a molecular weight of 245.72 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)methoxy]piperidine;hydrochloride is sourced from PubChem (CID 46735675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).