5-fluoro-2-quinoxalin-2-yloxyaniline

C14H10FN3O — CID 62369839

IUPAC5-fluoro-2-quinoxalin-2-yloxyaniline
SMILESNc1cc(F)ccc1Oc1cnc2ccccc2n1
InChIInChI=1S/C14H10FN3O/c15-9-5-6-13(10(16)7-9)19-14-8-17-11-3-1-2-4-12(11)18-14/h1-8H,16H2
InChIKeyKYGADQKBZKKHBZ-UHFFFAOYSA-N
MW255.25 g/mol
LogP3.14
Rot. Bonds2

About 5-fluoro-2-quinoxalin-2-yloxyaniline

5-fluoro-2-quinoxalin-2-yloxyaniline (PubChem CID 62369839) has the molecular formula C14H10FN3O and a molecular weight of 255.25 g/mol. Its IUPAC name is 5-fluoro-2-quinoxalin-2-yloxyaniline.

Molecular Properties

Compound Name5-fluoro-2-quinoxalin-2-yloxyaniline
PubChem CID62369839
Molecular FormulaC14H10FN3O
Molecular Weight255.25 g/mol
Exact Mass255.08
IUPAC Name5-fluoro-2-quinoxalin-2-yloxyaniline
SMILESNc1cc(F)ccc1Oc1cnc2ccccc2n1
InChIInChI=1S/C14H10FN3O/c15-9-5-6-13(10(16)7-9)19-14-8-17-11-3-1-2-4-12(11)18-14/h1-8H,16H2
InChIKeyKYGADQKBZKKHBZ-UHFFFAOYSA-N
XLogP3.14
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.25
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

6-(2-Fluorophenoxy)pyridin-3-amine
CID 2800656
Pyridine, 5-amino-2,3'-oxydi-
CID 2800156
6-(4-Fluorophenoxy)pyridin-3-amine
CID 421224
3-Amino-2-(4-fluorophenoxy)pyridine
CID 2735921
2-(2,4-Difluorophenoxy)-3-pyridinamine
CID 2735906
2-(2-Chlorophenoxy)quinoxaline
CID 4269635
N-[3-(2-quinoxalinyloxy)phenyl]acetamide
CID 1473208
2-(4-Nitrophenoxy)quinoxaline
CID 3714373
3-Amino-2-(2-fluorophenoxy)pyridine
CID 2735920
2-Phenoxyquinoxaline
CID 3734282
2-(Pyridin-3-Yloxy)Aniline
CID 12673493
2-(4-Methoxyphenoxy)-3-(trifluoromethyl)quinoxaline
CID 1470962

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-quinoxalin-2-yloxyaniline?
The IUPAC name of 5-fluoro-2-quinoxalin-2-yloxyaniline (CID 62369839) is 5-fluoro-2-quinoxalin-2-yloxyaniline.
What is the SMILES notation for 5-fluoro-2-quinoxalin-2-yloxyaniline?
The canonical SMILES for 5-fluoro-2-quinoxalin-2-yloxyaniline is Nc1cc(F)ccc1Oc1cnc2ccccc2n1.
What is the InChIKey of 5-fluoro-2-quinoxalin-2-yloxyaniline?
The InChIKey is KYGADQKBZKKHBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O/c15-9-5-6-13(10(16)7-9)19-14-8-17-11-3-1-2-4-12(11)18-14/h1-8H,16H2.
What are the key properties of 5-fluoro-2-quinoxalin-2-yloxyaniline?
5-fluoro-2-quinoxalin-2-yloxyaniline has a molecular weight of 255.25 g/mol, XLogP of 3.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-quinoxalin-2-yloxyaniline is sourced from PubChem (CID 62369839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).