2-(2-bromo-3-fluorophenyl)piperidine

C11H13BrFN — CID 84709368

IUPAC2-(2-bromo-3-fluorophenyl)piperidine
SMILESFc1cccc(C2CCCCN2)c1Br
InChIInChI=1S/C11H13BrFN/c12-11-8(4-3-5-9(11)13)10-6-1-2-7-14-10/h3-5,10,14H,1-2,6-7H2
InChIKeyCILPFPLLDXNBNN-UHFFFAOYSA-N
MW258.13 g/mol
LogP3.40
Rot. Bonds1

About 2-(2-bromo-3-fluorophenyl)piperidine

2-(2-bromo-3-fluorophenyl)piperidine (PubChem CID 84709368) has the molecular formula C11H13BrFN and a molecular weight of 258.13 g/mol. Its IUPAC name is 2-(2-bromo-3-fluorophenyl)piperidine.

Molecular Properties

Compound Name2-(2-bromo-3-fluorophenyl)piperidine
PubChem CID84709368
Molecular FormulaC11H13BrFN
Molecular Weight258.13 g/mol
Exact Mass257.02
IUPAC Name2-(2-bromo-3-fluorophenyl)piperidine
SMILESFc1cccc(C2CCCCN2)c1Br
InChIInChI=1S/C11H13BrFN/c12-11-8(4-3-5-9(11)13)10-6-1-2-7-14-10/h3-5,10,14H,1-2,6-7H2
InChIKeyCILPFPLLDXNBNN-UHFFFAOYSA-N
XLogP3.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.13
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-bromo-3,4-difluorophenyl)piperidine
CID 84714328
2-(3-bromo-4-fluoro-2-methylphenyl)piperidine
CID 84809680
2-(3-bromo-2-fluorophenyl)azepane
CID 106646528
(2R)-2-(3-bromo-2-fluorophenyl)piperidine;hydrochloride
CID 171195428
(2S)-2-(2,3-dibromophenyl)pyrrolidine
CID 131217135
2-(2-bromo-3-methoxyphenyl)piperidine
CID 84712674
2-(3-bromo-4-fluoro-2-methylphenyl)pyrrolidine
CID 84805783
(2S)-2-(2-fluorophenyl)pyrrolidine;hydrochloride
CID 66518510
(2R)-2-(2-fluorophenyl)pyrrolidine;methane
CID 161076171
(3S)-3-(2-bromo-3-fluorophenyl)morpholine;hydrochloride
CID 171193150
2-bromo-3-[(2S)-pyrrolidin-2-yl]benzonitrile
CID 130644804
2-(4-bromo-2-fluoro-3-methylphenyl)piperidine
CID 117432838

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-3-fluorophenyl)piperidine?
The IUPAC name of 2-(2-bromo-3-fluorophenyl)piperidine (CID 84709368) is 2-(2-bromo-3-fluorophenyl)piperidine.
What is the SMILES notation for 2-(2-bromo-3-fluorophenyl)piperidine?
The canonical SMILES for 2-(2-bromo-3-fluorophenyl)piperidine is Fc1cccc(C2CCCCN2)c1Br.
What is the InChIKey of 2-(2-bromo-3-fluorophenyl)piperidine?
The InChIKey is CILPFPLLDXNBNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrFN/c12-11-8(4-3-5-9(11)13)10-6-1-2-7-14-10/h3-5,10,14H,1-2,6-7H2.
What are the key properties of 2-(2-bromo-3-fluorophenyl)piperidine?
2-(2-bromo-3-fluorophenyl)piperidine has a molecular weight of 258.13 g/mol, XLogP of 3.40, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-3-fluorophenyl)piperidine is sourced from PubChem (CID 84709368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).