1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine

C16H16F2N2 — CID 11708865

IUPAC1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine
SMILESFc1cc(-c2ccccc2F)cc(N2CCNCC2)c1
InChIInChI=1S/C16H16F2N2/c17-13-9-12(15-3-1-2-4-16(15)18)10-14(11-13)20-7-5-19-6-8-20/h1-4,9-11,19H,5-8H2
InChIKeyGQEPTNSSTADQFD-UHFFFAOYSA-N
MW274.31 g/mol
LogP3.04
Rot. Bonds2

About 1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine

1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine (PubChem CID 11708865) has the molecular formula C16H16F2N2 and a molecular weight of 274.31 g/mol. Its IUPAC name is 1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine.

Molecular Properties

Compound Name1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine
PubChem CID11708865
Molecular FormulaC16H16F2N2
Molecular Weight274.31 g/mol
Exact Mass274.13
IUPAC Name1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine
SMILESFc1cc(-c2ccccc2F)cc(N2CCNCC2)c1
InChIInChI=1S/C16H16F2N2/c17-13-9-12(15-3-1-2-4-16(15)18)10-14(11-13)20-7-5-19-6-8-20/h1-4,9-11,19H,5-8H2
InChIKeyGQEPTNSSTADQFD-UHFFFAOYSA-N
XLogP3.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.31
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine?
The IUPAC name of 1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine (CID 11708865) is 1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine.
What is the SMILES notation for 1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine?
The canonical SMILES for 1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine is Fc1cc(-c2ccccc2F)cc(N2CCNCC2)c1.
What is the InChIKey of 1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine?
The InChIKey is GQEPTNSSTADQFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2N2/c17-13-9-12(15-3-1-2-4-16(15)18)10-14(11-13)20-7-5-19-6-8-20/h1-4,9-11,19H,5-8H2.
What are the key properties of 1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine?
1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine has a molecular weight of 274.31 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-fluoro-5-(2-fluorophenyl)phenyl]piperazine is sourced from PubChem (CID 11708865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).