(2R)-2-(2,6-difluoro-3-methylphenyl)piperidine

C12H15F2N — CID 131271517

IUPAC(2R)-2-(2,6-difluoro-3-methylphenyl)piperidine
SMILESCc1ccc(F)c([C@H]2CCCCN2)c1F
InChIInChI=1S/C12H15F2N/c1-8-5-6-9(13)11(12(8)14)10-4-2-3-7-15-10/h5-6,10,15H,2-4,7H2,1H3/t10-/m1/s1
InChIKeySZAKOQHVAHSTLX-SNVBAGLBSA-N
MW211.25 g/mol
LogP3.09
Rot. Bonds1

About (2R)-2-(2,6-difluoro-3-methylphenyl)piperidine

(2R)-2-(2,6-difluoro-3-methylphenyl)piperidine (PubChem CID 131271517) has the molecular formula C12H15F2N and a molecular weight of 211.25 g/mol. Its IUPAC name is (2R)-2-(2,6-difluoro-3-methylphenyl)piperidine.

Molecular Properties

Compound Name(2R)-2-(2,6-difluoro-3-methylphenyl)piperidine
PubChem CID131271517
Molecular FormulaC12H15F2N
Molecular Weight211.25 g/mol
Exact Mass211.12
IUPAC Name(2R)-2-(2,6-difluoro-3-methylphenyl)piperidine
SMILESCc1ccc(F)c([C@H]2CCCCN2)c1F
InChIInChI=1S/C12H15F2N/c1-8-5-6-9(13)11(12(8)14)10-4-2-3-7-15-10/h5-6,10,15H,2-4,7H2,1H3/t10-/m1/s1
InChIKeySZAKOQHVAHSTLX-SNVBAGLBSA-N
XLogP3.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.25
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-(2,6-difluoro-3-methylphenyl)pyrrolidine
CID 66518496
2-(2,6-difluoro-3-methylphenyl)pyrrolidine;hydrochloride
CID 138040825
(2R)-2-(2-chloro-6-fluoro-3-methylphenyl)pyrrolidine
CID 66518682
2-(2-bromo-6-fluoro-3-methylphenyl)pyrrolidine
CID 84709372
2-(2,3-difluoro-4-methylphenyl)piperidine
CID 84678474
2-(2,6-difluoro-3-methylsulfanylphenyl)pyrrolidine
CID 117330920
2,4-difluoro-3-pyrrolidin-2-ylphenol
CID 84775150
(2S)-2-(3-chloro-2,6-difluorophenyl)pyrrolidine;hydrochloride
CID 171196413
(2S)-2-(2,6-difluoro-3-methoxyphenyl)pyrrolidine;hydrochloride
CID 171196574
3-fluoro-2-methyl-6-[(2R)-piperidin-2-yl]pyridine
CID 130972186
(2R)-2-(2,6-dimethylphenyl)piperidine;hydrochloride
CID 171195444
2-(3-bromo-6-fluoro-2-methoxyphenyl)piperidine
CID 117465059

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,6-difluoro-3-methylphenyl)piperidine?
The IUPAC name of (2R)-2-(2,6-difluoro-3-methylphenyl)piperidine (CID 131271517) is (2R)-2-(2,6-difluoro-3-methylphenyl)piperidine.
What is the SMILES notation for (2R)-2-(2,6-difluoro-3-methylphenyl)piperidine?
The canonical SMILES for (2R)-2-(2,6-difluoro-3-methylphenyl)piperidine is Cc1ccc(F)c([C@H]2CCCCN2)c1F.
What is the InChIKey of (2R)-2-(2,6-difluoro-3-methylphenyl)piperidine?
The InChIKey is SZAKOQHVAHSTLX-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H15F2N/c1-8-5-6-9(13)11(12(8)14)10-4-2-3-7-15-10/h5-6,10,15H,2-4,7H2,1H3/t10-/m1/s1.
What are the key properties of (2R)-2-(2,6-difluoro-3-methylphenyl)piperidine?
(2R)-2-(2,6-difluoro-3-methylphenyl)piperidine has a molecular weight of 211.25 g/mol, XLogP of 3.09, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,6-difluoro-3-methylphenyl)piperidine is sourced from PubChem (CID 131271517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).