2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine

C18H17FN4O — CID 6482911

IUPAC2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine
SMILESFc1ccc(N2CCN(c3cncc(-c4ccoc4)n3)CC2)cc1
InChIInChI=1S/C18H17FN4O/c19-15-1-3-16(4-2-15)22-6-8-23(9-7-22)18-12-20-11-17(21-18)14-5-10-24-13-14/h1-5,10-13H,6-9H2
InChIKeyVJQHAOUTXUIQTQ-UHFFFAOYSA-N
MW324.36 g/mol
LogP3.20
Rot. Bonds3

About 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine

2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine (PubChem CID 6482911) has the molecular formula C18H17FN4O and a molecular weight of 324.36 g/mol. Its IUPAC name is 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine.

Molecular Properties

Compound Name2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine
PubChem CID6482911
Molecular FormulaC18H17FN4O
Molecular Weight324.36 g/mol
Exact Mass324.14
IUPAC Name2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine
SMILESFc1ccc(N2CCN(c3cncc(-c4ccoc4)n3)CC2)cc1
InChIInChI=1S/C18H17FN4O/c19-15-1-3-16(4-2-15)22-6-8-23(9-7-22)18-12-20-11-17(21-18)14-5-10-24-13-14/h1-5,10-13H,6-9H2
InChIKeyVJQHAOUTXUIQTQ-UHFFFAOYSA-N
XLogP3.20
TPSA45.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine
CID 6483160
4-(4-fluorophenyl)-1-(6-pyrimidin-5-ylpyrazin-2-yl)piperidin-4-ol
CID 155263855
2-(4-ethoxyphenyl)-6-[4-(4-methylphenyl)piperazin-1-yl]pyrazine
CID 6482907
2-(4-phenylpiperazin-1-yl)-6-[6-(trifluoromethyl)-3-pyridinyl]pyrazine
CID 177153206
4-(4-fluorophenyl)-1-[6-(4-methoxyphenyl)pyrazin-2-yl]piperidin-4-ol
CID 155263820
2-(4-fluorophenyl)-6-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]pyrazine
CID 166208312
4-[6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]benzamide
CID 6482931
4-(4-fluorophenyl)-1-[6-(4-methylsulfonylphenyl)pyrazin-2-yl]piperidin-4-ol
CID 155263877
4-[4-(4-fluorophenyl)piperazin-1-yl]-2-(4-methylpiperazin-1-yl)pyrimidine
CID 112888108
2-phenyl-6-piperazin-1-ylpyrazine;hydrochloride
CID 90674681
4-[6-[4-(2-fluorophenyl)piperazin-1-yl]pyrazin-2-yl]-N,N-dimethylaniline
CID 6482838
5-[6-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole
CID 53054502

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine?
The IUPAC name of 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine (CID 6482911) is 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine.
What is the SMILES notation for 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine?
The canonical SMILES for 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine is Fc1ccc(N2CCN(c3cncc(-c4ccoc4)n3)CC2)cc1.
What is the InChIKey of 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine?
The InChIKey is VJQHAOUTXUIQTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4O/c19-15-1-3-16(4-2-15)22-6-8-23(9-7-22)18-12-20-11-17(21-18)14-5-10-24-13-14/h1-5,10-13H,6-9H2.
What are the key properties of 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine?
2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine has a molecular weight of 324.36 g/mol, XLogP of 3.20, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-(furan-3-yl)pyrazine is sourced from PubChem (CID 6482911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).