1-benzyl-4-(4-fluorophenyl)piperazine

C17H19FN2 — CID 763199

IUPAC1-benzyl-4-(4-fluorophenyl)piperazine
SMILESFc1ccc(N2CCN(Cc3ccccc3)CC2)cc1
InChIInChI=1S/C17H19FN2/c18-16-6-8-17(9-7-16)20-12-10-19(11-13-20)14-15-4-2-1-3-5-15/h1-9H,10-14H2
InChIKeyVOONTWFRLJYNOE-UHFFFAOYSA-N
MW270.35 g/mol
LogP3.15
Rot. Bonds3

About 1-benzyl-4-(4-fluorophenyl)piperazine

1-benzyl-4-(4-fluorophenyl)piperazine (PubChem CID 763199) has the molecular formula C17H19FN2 and a molecular weight of 270.35 g/mol. Its IUPAC name is 1-benzyl-4-(4-fluorophenyl)piperazine.

Molecular Properties

Compound Name1-benzyl-4-(4-fluorophenyl)piperazine
PubChem CID763199
Molecular FormulaC17H19FN2
Molecular Weight270.35 g/mol
Exact Mass270.15
IUPAC Name1-benzyl-4-(4-fluorophenyl)piperazine
SMILESFc1ccc(N2CCN(Cc3ccccc3)CC2)cc1
InChIInChI=1S/C17H19FN2/c18-16-6-8-17(9-7-16)20-12-10-19(11-13-20)14-15-4-2-1-3-5-15/h1-9H,10-14H2
InChIKeyVOONTWFRLJYNOE-UHFFFAOYSA-N
XLogP3.15
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4-(4-fluorophenyl)piperazine?
The IUPAC name of 1-benzyl-4-(4-fluorophenyl)piperazine (CID 763199) is 1-benzyl-4-(4-fluorophenyl)piperazine.
What is the SMILES notation for 1-benzyl-4-(4-fluorophenyl)piperazine?
The canonical SMILES for 1-benzyl-4-(4-fluorophenyl)piperazine is Fc1ccc(N2CCN(Cc3ccccc3)CC2)cc1.
What is the InChIKey of 1-benzyl-4-(4-fluorophenyl)piperazine?
The InChIKey is VOONTWFRLJYNOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2/c18-16-6-8-17(9-7-16)20-12-10-19(11-13-20)14-15-4-2-1-3-5-15/h1-9H,10-14H2.
What are the key properties of 1-benzyl-4-(4-fluorophenyl)piperazine?
1-benzyl-4-(4-fluorophenyl)piperazine has a molecular weight of 270.35 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-(4-fluorophenyl)piperazine is sourced from PubChem (CID 763199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).