2,3-bis(3,5-difluorophenyl)quinoxaline

C20H10F4N2 — CID 58389303

IUPAC2,3-bis(3,5-difluorophenyl)quinoxaline
SMILESFc1cc(F)cc(-c2nc3ccccc3nc2-c2cc(F)cc(F)c2)c1
InChIInChI=1S/C20H10F4N2/c21-13-5-11(6-14(22)9-13)19-20(12-7-15(23)10-16(24)8-12)26-18-4-2-1-3-17(18)25-19/h1-10H
InChIKeyLNNVLYOEIMVUEC-UHFFFAOYSA-N
MW354.31 g/mol
LogP5.52
Rot. Bonds2

About 2,3-bis(3,5-difluorophenyl)quinoxaline

2,3-bis(3,5-difluorophenyl)quinoxaline (PubChem CID 58389303) has the molecular formula C20H10F4N2 and a molecular weight of 354.31 g/mol. Its IUPAC name is 2,3-bis(3,5-difluorophenyl)quinoxaline.

Molecular Properties

Compound Name2,3-bis(3,5-difluorophenyl)quinoxaline
PubChem CID58389303
Molecular FormulaC20H10F4N2
Molecular Weight354.31 g/mol
Exact Mass354.08
IUPAC Name2,3-bis(3,5-difluorophenyl)quinoxaline
SMILESFc1cc(F)cc(-c2nc3ccccc3nc2-c2cc(F)cc(F)c2)c1
InChIInChI=1S/C20H10F4N2/c21-13-5-11(6-14(22)9-13)19-20(12-7-15(23)10-16(24)8-12)26-18-4-2-1-3-17(18)25-19/h1-10H
InChIKeyLNNVLYOEIMVUEC-UHFFFAOYSA-N
XLogP5.52
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.31
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-bis(3,5-difluorophenyl)quinoxaline?
The IUPAC name of 2,3-bis(3,5-difluorophenyl)quinoxaline (CID 58389303) is 2,3-bis(3,5-difluorophenyl)quinoxaline.
What is the SMILES notation for 2,3-bis(3,5-difluorophenyl)quinoxaline?
The canonical SMILES for 2,3-bis(3,5-difluorophenyl)quinoxaline is Fc1cc(F)cc(-c2nc3ccccc3nc2-c2cc(F)cc(F)c2)c1.
What is the InChIKey of 2,3-bis(3,5-difluorophenyl)quinoxaline?
The InChIKey is LNNVLYOEIMVUEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H10F4N2/c21-13-5-11(6-14(22)9-13)19-20(12-7-15(23)10-16(24)8-12)26-18-4-2-1-3-17(18)25-19/h1-10H.
What are the key properties of 2,3-bis(3,5-difluorophenyl)quinoxaline?
2,3-bis(3,5-difluorophenyl)quinoxaline has a molecular weight of 354.31 g/mol, XLogP of 5.52, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(3,5-difluorophenyl)quinoxaline is sourced from PubChem (CID 58389303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).