2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline

C16H11F3N2O2 — CID 1470962

IUPAC2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline
SMILESCOc1ccc(Oc2nc3ccccc3nc2C(F)(F)F)cc1
InChIInChI=1S/C16H11F3N2O2/c1-22-10-6-8-11(9-7-10)23-15-14(16(17,18)19)20-12-4-2-3-5-13(12)21-15/h2-9H,1H3
InChIKeyAURRUUAVZIMCTE-UHFFFAOYSA-N
MW320.27 g/mol
LogP4.45
Rot. Bonds3

About 2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline

2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline (PubChem CID 1470962) has the molecular formula C16H11F3N2O2 and a molecular weight of 320.27 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline
PubChem CID1470962
Molecular FormulaC16H11F3N2O2
Molecular Weight320.27 g/mol
Exact Mass320.08
IUPAC Name2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline
SMILESCOc1ccc(Oc2nc3ccccc3nc2C(F)(F)F)cc1
InChIInChI=1S/C16H11F3N2O2/c1-22-10-6-8-11(9-7-10)23-15-14(16(17,18)19)20-12-4-2-3-5-13(12)21-15/h2-9H,1H3
InChIKeyAURRUUAVZIMCTE-UHFFFAOYSA-N
XLogP4.45
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.27
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline?
The IUPAC name of 2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline (CID 1470962) is 2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline.
What is the SMILES notation for 2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline?
The canonical SMILES for 2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline is COc1ccc(Oc2nc3ccccc3nc2C(F)(F)F)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline?
The InChIKey is AURRUUAVZIMCTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F3N2O2/c1-22-10-6-8-11(9-7-10)23-15-14(16(17,18)19)20-12-4-2-3-5-13(12)21-15/h2-9H,1H3.
What are the key properties of 2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline?
2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline has a molecular weight of 320.27 g/mol, XLogP of 4.45, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-3-(trifluoromethyl)quinoxaline is sourced from PubChem (CID 1470962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).