2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline

C15H8ClF3N2O — CID 1470969

IUPAC2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline
SMILESFC(F)(F)c1nc2ccccc2nc1Oc1cccc(Cl)c1
InChIInChI=1S/C15H8ClF3N2O/c16-9-4-3-5-10(8-9)22-14-13(15(17,18)19)20-11-6-1-2-7-12(11)21-14/h1-8H
InChIKeyMICVIEOOEVCUFA-UHFFFAOYSA-N
MW324.69 g/mol
LogP5.09
Rot. Bonds2

About 2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline

2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline (PubChem CID 1470969) has the molecular formula C15H8ClF3N2O and a molecular weight of 324.69 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline
PubChem CID1470969
Molecular FormulaC15H8ClF3N2O
Molecular Weight324.69 g/mol
Exact Mass324.03
IUPAC Name2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline
SMILESFC(F)(F)c1nc2ccccc2nc1Oc1cccc(Cl)c1
InChIInChI=1S/C15H8ClF3N2O/c16-9-4-3-5-10(8-9)22-14-13(15(17,18)19)20-11-6-1-2-7-12(11)21-14/h1-8H
InChIKeyMICVIEOOEVCUFA-UHFFFAOYSA-N
XLogP5.09
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.69
LogP ≤ 55.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline?
The IUPAC name of 2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline (CID 1470969) is 2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline.
What is the SMILES notation for 2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline?
The canonical SMILES for 2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline is FC(F)(F)c1nc2ccccc2nc1Oc1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline?
The InChIKey is MICVIEOOEVCUFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8ClF3N2O/c16-9-4-3-5-10(8-9)22-14-13(15(17,18)19)20-11-6-1-2-7-12(11)21-14/h1-8H.
What are the key properties of 2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline?
2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline has a molecular weight of 324.69 g/mol, XLogP of 5.09, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-3-(trifluoromethyl)quinoxaline is sourced from PubChem (CID 1470969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).