2-(4-bromophenyl)quinoxaline

C14H9BrN2 — CID 762079

IUPAC2-(4-bromophenyl)quinoxaline
SMILESBrc1ccc(-c2cnc3ccccc3n2)cc1
InChIInChI=1S/C14H9BrN2/c15-11-7-5-10(6-8-11)14-9-16-12-3-1-2-4-13(12)17-14/h1-9H
InChIKeyFXKZRBJBUFVFNR-UHFFFAOYSA-N
MW285.14 g/mol
LogP4.06
Rot. Bonds1

About 2-(4-bromophenyl)quinoxaline

2-(4-bromophenyl)quinoxaline (PubChem CID 762079) has the molecular formula C14H9BrN2 and a molecular weight of 285.14 g/mol. Its IUPAC name is 2-(4-bromophenyl)quinoxaline.

Molecular Properties

Compound Name2-(4-bromophenyl)quinoxaline
PubChem CID762079
Molecular FormulaC14H9BrN2
Molecular Weight285.14 g/mol
Exact Mass283.99
IUPAC Name2-(4-bromophenyl)quinoxaline
SMILESBrc1ccc(-c2cnc3ccccc3n2)cc1
InChIInChI=1S/C14H9BrN2/c15-11-7-5-10(6-8-11)14-9-16-12-3-1-2-4-13(12)17-14/h1-9H
InChIKeyFXKZRBJBUFVFNR-UHFFFAOYSA-N
XLogP4.06
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.14
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)quinoxaline?
The IUPAC name of 2-(4-bromophenyl)quinoxaline (CID 762079) is 2-(4-bromophenyl)quinoxaline.
What is the SMILES notation for 2-(4-bromophenyl)quinoxaline?
The canonical SMILES for 2-(4-bromophenyl)quinoxaline is Brc1ccc(-c2cnc3ccccc3n2)cc1.
What is the InChIKey of 2-(4-bromophenyl)quinoxaline?
The InChIKey is FXKZRBJBUFVFNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9BrN2/c15-11-7-5-10(6-8-11)14-9-16-12-3-1-2-4-13(12)17-14/h1-9H.
What are the key properties of 2-(4-bromophenyl)quinoxaline?
2-(4-bromophenyl)quinoxaline has a molecular weight of 285.14 g/mol, XLogP of 4.06, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)quinoxaline is sourced from PubChem (CID 762079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).