2-(4-phenylpiperazin-1-yl)quinoxaline

C18H18N4 — CID 3812356

IUPAC2-(4-phenylpiperazin-1-yl)quinoxaline
SMILESc1ccc(N2CCN(c3cnc4ccccc4n3)CC2)cc1
InChIInChI=1S/C18H18N4/c1-2-6-15(7-3-1)21-10-12-22(13-11-21)18-14-19-16-8-4-5-9-17(16)20-18/h1-9,14H,10-13H2
InChIKeyQGSFDXOMOOGDSK-UHFFFAOYSA-N
MW290.37 g/mol
LogP2.96
Rot. Bonds2

About 2-(4-phenylpiperazin-1-yl)quinoxaline

2-(4-phenylpiperazin-1-yl)quinoxaline (PubChem CID 3812356) has the molecular formula C18H18N4 and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-(4-phenylpiperazin-1-yl)quinoxaline.

Molecular Properties

Compound Name2-(4-phenylpiperazin-1-yl)quinoxaline
PubChem CID3812356
Molecular FormulaC18H18N4
Molecular Weight290.37 g/mol
Exact Mass290.15
IUPAC Name2-(4-phenylpiperazin-1-yl)quinoxaline
SMILESc1ccc(N2CCN(c3cnc4ccccc4n3)CC2)cc1
InChIInChI=1S/C18H18N4/c1-2-6-15(7-3-1)21-10-12-22(13-11-21)18-14-19-16-8-4-5-9-17(16)20-18/h1-9,14H,10-13H2
InChIKeyQGSFDXOMOOGDSK-UHFFFAOYSA-N
XLogP2.96
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylpiperazin-1-yl)quinoxaline?
The IUPAC name of 2-(4-phenylpiperazin-1-yl)quinoxaline (CID 3812356) is 2-(4-phenylpiperazin-1-yl)quinoxaline.
What is the SMILES notation for 2-(4-phenylpiperazin-1-yl)quinoxaline?
The canonical SMILES for 2-(4-phenylpiperazin-1-yl)quinoxaline is c1ccc(N2CCN(c3cnc4ccccc4n3)CC2)cc1.
What is the InChIKey of 2-(4-phenylpiperazin-1-yl)quinoxaline?
The InChIKey is QGSFDXOMOOGDSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4/c1-2-6-15(7-3-1)21-10-12-22(13-11-21)18-14-19-16-8-4-5-9-17(16)20-18/h1-9,14H,10-13H2.
What are the key properties of 2-(4-phenylpiperazin-1-yl)quinoxaline?
2-(4-phenylpiperazin-1-yl)quinoxaline has a molecular weight of 290.37 g/mol, XLogP of 2.96, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylpiperazin-1-yl)quinoxaline is sourced from PubChem (CID 3812356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).