(2R)-2-(2-fluoro-6-methylphenyl)piperazine

C11H15FN2 — CID 131128781

IUPAC(2R)-2-(2-fluoro-6-methylphenyl)piperazine
SMILESCc1cccc(F)c1[C@@H]1CNCCN1
InChIInChI=1S/C11H15FN2/c1-8-3-2-4-9(12)11(8)10-7-13-5-6-14-10/h2-4,10,13-14H,5-7H2,1H3/t10-/m0/s1
InChIKeyYXYJPZFZGRDLIB-JTQLQIEISA-N
MW194.25 g/mol
LogP1.37
Rot. Bonds1

About (2R)-2-(2-fluoro-6-methylphenyl)piperazine

(2R)-2-(2-fluoro-6-methylphenyl)piperazine (PubChem CID 131128781) has the molecular formula C11H15FN2 and a molecular weight of 194.25 g/mol. Its IUPAC name is (2R)-2-(2-fluoro-6-methylphenyl)piperazine.

Molecular Properties

Compound Name(2R)-2-(2-fluoro-6-methylphenyl)piperazine
PubChem CID131128781
Molecular FormulaC11H15FN2
Molecular Weight194.25 g/mol
Exact Mass194.12
IUPAC Name(2R)-2-(2-fluoro-6-methylphenyl)piperazine
SMILESCc1cccc(F)c1[C@@H]1CNCCN1
InChIInChI=1S/C11H15FN2/c1-8-3-2-4-9(12)11(8)10-7-13-5-6-14-10/h2-4,10,13-14H,5-7H2,1H3/t10-/m0/s1
InChIKeyYXYJPZFZGRDLIB-JTQLQIEISA-N
XLogP1.37
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(3-fluoro-2-methylphenyl)piperazine
CID 131101116
(2S)-2-(3-fluoro-2-methylphenyl)piperazine
CID 55264820
2-(2-methylphenyl)piperazine;dihydrochloride
CID 70608733
(2R)-2-(2,3,4,5,6-pentafluorophenyl)piperazine;hydrochloride
CID 171194542
(2S)-2-(3-bromo-2,6-difluorophenyl)piperazine
CID 131548332
(2R)-2-(4-fluoro-3-methylphenyl)piperazine;hydrochloride
CID 171194333
3-chloro-6-fluoro-2-[(2S)-piperazin-2-yl]phenol
CID 171259613
(2S)-2-(2,4-dimethylphenyl)piperazine
CID 55264314
(2R)-2-(3,6-dichloro-2-fluorophenyl)piperazine
CID 171194726
2-(3-fluoro-1-oxidopyridin-1-ium-2-yl)piperazine
CID 70481610
2-phenyl-1,4,7,10-tetrazacyclododecane
CID 10901007
2-methyl-3-[(2S)-piperazin-2-yl]-1H-indole
CID 95441892

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-fluoro-6-methylphenyl)piperazine?
The IUPAC name of (2R)-2-(2-fluoro-6-methylphenyl)piperazine (CID 131128781) is (2R)-2-(2-fluoro-6-methylphenyl)piperazine.
What is the SMILES notation for (2R)-2-(2-fluoro-6-methylphenyl)piperazine?
The canonical SMILES for (2R)-2-(2-fluoro-6-methylphenyl)piperazine is Cc1cccc(F)c1[C@@H]1CNCCN1.
What is the InChIKey of (2R)-2-(2-fluoro-6-methylphenyl)piperazine?
The InChIKey is YXYJPZFZGRDLIB-JTQLQIEISA-N. The full InChI is InChI=1S/C11H15FN2/c1-8-3-2-4-9(12)11(8)10-7-13-5-6-14-10/h2-4,10,13-14H,5-7H2,1H3/t10-/m0/s1.
What are the key properties of (2R)-2-(2-fluoro-6-methylphenyl)piperazine?
(2R)-2-(2-fluoro-6-methylphenyl)piperazine has a molecular weight of 194.25 g/mol, XLogP of 1.37, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-fluoro-6-methylphenyl)piperazine is sourced from PubChem (CID 131128781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).