2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine

C20H19FN4 — CID 6482758

IUPAC2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine
SMILESFc1ccc(-c2cncc(N3CCN(c4ccccc4)CC3)n2)cc1
InChIInChI=1S/C20H19FN4/c21-17-8-6-16(7-9-17)19-14-22-15-20(23-19)25-12-10-24(11-13-25)18-4-2-1-3-5-18/h1-9,14-15H,10-13H2
InChIKeyXPHMTYVFFXCMIE-UHFFFAOYSA-N
MW334.40 g/mol
LogP3.61
Rot. Bonds3

About 2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine

2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine (PubChem CID 6482758) has the molecular formula C20H19FN4 and a molecular weight of 334.40 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine
PubChem CID6482758
Molecular FormulaC20H19FN4
Molecular Weight334.40 g/mol
Exact Mass334.16
IUPAC Name2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine
SMILESFc1ccc(-c2cncc(N3CCN(c4ccccc4)CC3)n2)cc1
InChIInChI=1S/C20H19FN4/c21-17-8-6-16(7-9-17)19-14-22-15-20(23-19)25-12-10-24(11-13-25)18-4-2-1-3-5-18/h1-9,14-15H,10-13H2
InChIKeyXPHMTYVFFXCMIE-UHFFFAOYSA-N
XLogP3.61
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine?
The IUPAC name of 2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine (CID 6482758) is 2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine.
What is the SMILES notation for 2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine?
The canonical SMILES for 2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine is Fc1ccc(-c2cncc(N3CCN(c4ccccc4)CC3)n2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine?
The InChIKey is XPHMTYVFFXCMIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4/c21-17-8-6-16(7-9-17)19-14-22-15-20(23-19)25-12-10-24(11-13-25)18-4-2-1-3-5-18/h1-9,14-15H,10-13H2.
What are the key properties of 2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine?
2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine has a molecular weight of 334.40 g/mol, XLogP of 3.61, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-6-(4-phenylpiperazin-1-yl)pyrazine is sourced from PubChem (CID 6482758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).