2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine

C20H18F2N4 — CID 6482761

IUPAC2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine
SMILESFc1ccc(-c2cncc(N3CCN(c4ccccc4F)CC3)n2)cc1
InChIInChI=1S/C20H18F2N4/c21-16-7-5-15(6-8-16)18-13-23-14-20(24-18)26-11-9-25(10-12-26)19-4-2-1-3-17(19)22/h1-8,13-14H,9-12H2
InChIKeyCMQWTFKLVSGHOO-UHFFFAOYSA-N
MW352.39 g/mol
LogP3.75
Rot. Bonds3

About 2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine

2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine (PubChem CID 6482761) has the molecular formula C20H18F2N4 and a molecular weight of 352.39 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine
PubChem CID6482761
Molecular FormulaC20H18F2N4
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC Name2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine
SMILESFc1ccc(-c2cncc(N3CCN(c4ccccc4F)CC3)n2)cc1
InChIInChI=1S/C20H18F2N4/c21-16-7-5-15(6-8-16)18-13-23-14-20(24-18)26-11-9-25(10-12-26)19-4-2-1-3-17(19)22/h1-8,13-14H,9-12H2
InChIKeyCMQWTFKLVSGHOO-UHFFFAOYSA-N
XLogP3.75
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 53.75
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-(2-fluorophenyl)piperazin-1-yl]pyrazine?
The IUPAC name of 2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine (CID 6482761) is 2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine.
What is the SMILES notation for 2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine?
The canonical SMILES for 2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine is Fc1ccc(-c2cncc(N3CCN(c4ccccc4F)CC3)n2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine?
The InChIKey is CMQWTFKLVSGHOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18F2N4/c21-16-7-5-15(6-8-16)18-13-23-14-20(24-18)26-11-9-25(10-12-26)19-4-2-1-3-17(19)22/h1-8,13-14H,9-12H2.
What are the key properties of 2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine?
2-(4-fluorophenyl)-6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazine has a molecular weight of 352.39 g/mol, XLogP of 3.75, 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-(2-fluorophenyl)piperazin-1-yl]pyrazine is sourced from PubChem (CID 6482761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).