2-(2-bromophenyl)-3,3-difluoropiperidine

C11H12BrF2N — CID 84730265

IUPAC2-(2-bromophenyl)-3,3-difluoropiperidine
SMILESFC1(F)CCCNC1c1ccccc1Br
InChIInChI=1S/C11H12BrF2N/c12-9-5-2-1-4-8(9)10-11(13,14)6-3-7-15-10/h1-2,4-5,10,15H,3,6-7H2
InChIKeyANQPJBFYFNTBAA-UHFFFAOYSA-N
MW276.12 g/mol
LogP3.51
Rot. Bonds1

About 2-(2-bromophenyl)-3,3-difluoropiperidine

2-(2-bromophenyl)-3,3-difluoropiperidine (PubChem CID 84730265) has the molecular formula C11H12BrF2N and a molecular weight of 276.12 g/mol. Its IUPAC name is 2-(2-bromophenyl)-3,3-difluoropiperidine.

Molecular Properties

Compound Name2-(2-bromophenyl)-3,3-difluoropiperidine
PubChem CID84730265
Molecular FormulaC11H12BrF2N
Molecular Weight276.12 g/mol
Exact Mass275.01
IUPAC Name2-(2-bromophenyl)-3,3-difluoropiperidine
SMILESFC1(F)CCCNC1c1ccccc1Br
InChIInChI=1S/C11H12BrF2N/c12-9-5-2-1-4-8(9)10-11(13,14)6-3-7-15-10/h1-2,4-5,10,15H,3,6-7H2
InChIKeyANQPJBFYFNTBAA-UHFFFAOYSA-N
XLogP3.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.12
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(2-bromophenyl)-3,3-difluoropiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-bromophenyl)-3-fluoro-3-methylpyrrolidine
CID 84729407
2-(4-bromophenyl)-3,3-difluoropiperidine;hydrochloride
CID 115054389
2-(3,3-difluoropyrrolidin-2-yl)phenol
CID 84721047
3,3-difluoro-2-(2-methylphenyl)pyrrolidine;hydrochloride
CID 115039884
4-(3,3-difluoropiperidin-2-yl)pyridine
CID 138111206
2-(2-bromophenyl)imidazolidine
CID 10331308
(4R)-4-(2-bromophenyl)-5,5-difluoro-1,3-oxazinan-2-one
CID 171187559
3,3-difluoro-2-phenylpyrrolidine;hydrochloride
CID 84724544
3-(2-bromophenyl)-1,4-thiazepane
CID 66219747
2-(2-bromophenyl)-1,3-oxazinane
CID 82293281
2-(2-bromophenyl)piperidin-3-ol;hydrochloride
CID 115052990
2-(4-bromophenyl)-3-fluoro-3-methylpiperidine
CID 84730127

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-3,3-difluoropiperidine?
The IUPAC name of 2-(2-bromophenyl)-3,3-difluoropiperidine (CID 84730265) is 2-(2-bromophenyl)-3,3-difluoropiperidine.
What is the SMILES notation for 2-(2-bromophenyl)-3,3-difluoropiperidine?
The canonical SMILES for 2-(2-bromophenyl)-3,3-difluoropiperidine is FC1(F)CCCNC1c1ccccc1Br.
What is the InChIKey of 2-(2-bromophenyl)-3,3-difluoropiperidine?
The InChIKey is ANQPJBFYFNTBAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrF2N/c12-9-5-2-1-4-8(9)10-11(13,14)6-3-7-15-10/h1-2,4-5,10,15H,3,6-7H2.
What are the key properties of 2-(2-bromophenyl)-3,3-difluoropiperidine?
2-(2-bromophenyl)-3,3-difluoropiperidine has a molecular weight of 276.12 g/mol, XLogP of 3.51, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-3,3-difluoropiperidine is sourced from PubChem (CID 84730265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).