1-(2-fluoro-3-methoxyphenyl)piperazine

C11H15FN2O — CID 75481722

IUPAC1-(2-fluoro-3-methoxyphenyl)piperazine
SMILESCOc1cccc(N2CCNCC2)c1F
InChIInChI=1S/C11H15FN2O/c1-15-10-4-2-3-9(11(10)12)14-7-5-13-6-8-14/h2-4,13H,5-8H2,1H3
InChIKeyFACXPIAFKDEUQE-UHFFFAOYSA-N
MW210.25 g/mol
LogP1.24
Rot. Bonds2

About 1-(2-fluoro-3-methoxyphenyl)piperazine

1-(2-fluoro-3-methoxyphenyl)piperazine (PubChem CID 75481722) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is 1-(2-fluoro-3-methoxyphenyl)piperazine.

Molecular Properties

Compound Name1-(2-fluoro-3-methoxyphenyl)piperazine
PubChem CID75481722
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC Name1-(2-fluoro-3-methoxyphenyl)piperazine
SMILESCOc1cccc(N2CCNCC2)c1F
InChIInChI=1S/C11H15FN2O/c1-15-10-4-2-3-9(11(10)12)14-7-5-13-6-8-14/h2-4,13H,5-8H2,1H3
InChIKeyFACXPIAFKDEUQE-UHFFFAOYSA-N
XLogP1.24
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-3-methoxyphenyl)piperazine?
The IUPAC name of 1-(2-fluoro-3-methoxyphenyl)piperazine (CID 75481722) is 1-(2-fluoro-3-methoxyphenyl)piperazine.
What is the SMILES notation for 1-(2-fluoro-3-methoxyphenyl)piperazine?
The canonical SMILES for 1-(2-fluoro-3-methoxyphenyl)piperazine is COc1cccc(N2CCNCC2)c1F.
What is the InChIKey of 1-(2-fluoro-3-methoxyphenyl)piperazine?
The InChIKey is FACXPIAFKDEUQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c1-15-10-4-2-3-9(11(10)12)14-7-5-13-6-8-14/h2-4,13H,5-8H2,1H3.
What are the key properties of 1-(2-fluoro-3-methoxyphenyl)piperazine?
1-(2-fluoro-3-methoxyphenyl)piperazine has a molecular weight of 210.25 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-3-methoxyphenyl)piperazine is sourced from PubChem (CID 75481722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).