8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine

C15H10F3N3 — CID 44581673

IUPAC8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine
SMILESNc1cnc2cc(C(F)(F)F)cc(-c3ccccc3)c2n1
InChIInChI=1S/C15H10F3N3/c16-15(17,18)10-6-11(9-4-2-1-3-5-9)14-12(7-10)20-8-13(19)21-14/h1-8H,(H2,19,21)
InChIKeyACZDLMRHZIFBMB-UHFFFAOYSA-N
MW289.26 g/mol
LogP3.90
Rot. Bonds1

About 8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine

8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine (PubChem CID 44581673) has the molecular formula C15H10F3N3 and a molecular weight of 289.26 g/mol. Its IUPAC name is 8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine.

Molecular Properties

Compound Name8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine
PubChem CID44581673
Molecular FormulaC15H10F3N3
Molecular Weight289.26 g/mol
Exact Mass289.08
IUPAC Name8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine
SMILESNc1cnc2cc(C(F)(F)F)cc(-c3ccccc3)c2n1
InChIInChI=1S/C15H10F3N3/c16-15(17,18)10-6-11(9-4-2-1-3-5-9)14-12(7-10)20-8-13(19)21-14/h1-8H,(H2,19,21)
InChIKeyACZDLMRHZIFBMB-UHFFFAOYSA-N
XLogP3.90
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.26
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine?
The IUPAC name of 8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine (CID 44581673) is 8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine.
What is the SMILES notation for 8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine?
The canonical SMILES for 8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine is Nc1cnc2cc(C(F)(F)F)cc(-c3ccccc3)c2n1.
What is the InChIKey of 8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine?
The InChIKey is ACZDLMRHZIFBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F3N3/c16-15(17,18)10-6-11(9-4-2-1-3-5-9)14-12(7-10)20-8-13(19)21-14/h1-8H,(H2,19,21).
What are the key properties of 8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine?
8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine has a molecular weight of 289.26 g/mol, XLogP of 3.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-phenyl-6-(trifluoromethyl)quinoxalin-2-amine is sourced from PubChem (CID 44581673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).