4-[(3,4-difluorophenyl)methoxy]piperidine

C12H15F2NO — CID 67355988

IUPAC4-[(3,4-difluorophenyl)methoxy]piperidine
SMILESFc1ccc(COC2CCNCC2)cc1F
InChIInChI=1S/C12H15F2NO/c13-11-2-1-9(7-12(11)14)8-16-10-3-5-15-6-4-10/h1-2,7,10,15H,3-6,8H2
InChIKeyBKPMNSPQTPPKPL-UHFFFAOYSA-N
MW227.25 g/mol
LogP2.23
Rot. Bonds3

About 4-[(3,4-difluorophenyl)methoxy]piperidine

4-[(3,4-difluorophenyl)methoxy]piperidine (PubChem CID 67355988) has the molecular formula C12H15F2NO and a molecular weight of 227.25 g/mol. Its IUPAC name is 4-[(3,4-difluorophenyl)methoxy]piperidine.

Molecular Properties

Compound Name4-[(3,4-difluorophenyl)methoxy]piperidine
PubChem CID67355988
Molecular FormulaC12H15F2NO
Molecular Weight227.25 g/mol
Exact Mass227.11
IUPAC Name4-[(3,4-difluorophenyl)methoxy]piperidine
SMILESFc1ccc(COC2CCNCC2)cc1F
InChIInChI=1S/C12H15F2NO/c13-11-2-1-9(7-12(11)14)8-16-10-3-5-15-6-4-10/h1-2,7,10,15H,3-6,8H2
InChIKeyBKPMNSPQTPPKPL-UHFFFAOYSA-N
XLogP2.23
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.25
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(cyclobutyloxymethyl)-1,2-difluorobenzene
CID 155941931
4-[(3-fluoro-4-methoxyphenyl)methoxy]piperidine
CID 43167840
4-[[3-fluoro-4-(trifluoromethoxy)phenyl]methoxy]piperidine
CID 122238069
4-[(4-chlorophenyl)methoxy]piperidine
CID 13194424
(1R,5S)-3-[(3,4-difluorophenyl)methoxy]-8-azabicyclo[3.2.1]octane
CID 68673997
(1S,5R)-3-[(3,4-difluorophenyl)methoxy]-8-azabicyclo[3.2.1]octane;hydrochloride
CID 68673996
4-[(2,3,6-trifluorophenyl)methoxy]piperidine
CID 68519539
4-[(3-methylphenyl)methoxy]piperidine;hydrochloride
CID 45075442
4-[2-(3,4-difluorophenyl)-1-fluoroethyl]piperidine
CID 112563630
4-[3-(3,4-difluorophenyl)propyl]piperidine
CID 18187745
4-phenylmethoxyazepane
CID 63716383
4-[[2-fluoro-4-(trifluoromethyl)phenyl]methoxy]piperidine
CID 68521915

Frequently Asked Questions

What is the IUPAC name of 4-[(3,4-difluorophenyl)methoxy]piperidine?
The IUPAC name of 4-[(3,4-difluorophenyl)methoxy]piperidine (CID 67355988) is 4-[(3,4-difluorophenyl)methoxy]piperidine.
What is the SMILES notation for 4-[(3,4-difluorophenyl)methoxy]piperidine?
The canonical SMILES for 4-[(3,4-difluorophenyl)methoxy]piperidine is Fc1ccc(COC2CCNCC2)cc1F.
What is the InChIKey of 4-[(3,4-difluorophenyl)methoxy]piperidine?
The InChIKey is BKPMNSPQTPPKPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F2NO/c13-11-2-1-9(7-12(11)14)8-16-10-3-5-15-6-4-10/h1-2,7,10,15H,3-6,8H2.
What are the key properties of 4-[(3,4-difluorophenyl)methoxy]piperidine?
4-[(3,4-difluorophenyl)methoxy]piperidine has a molecular weight of 227.25 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3,4-difluorophenyl)methoxy]piperidine is sourced from PubChem (CID 67355988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).