3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine

C15H12FN3O — CID 107662445

IUPAC3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine
SMILESCc1cccc(Oc2nc3ccccc3nc2N)c1F
InChIInChI=1S/C15H12FN3O/c1-9-5-4-8-12(13(9)16)20-15-14(17)18-10-6-2-3-7-11(10)19-15/h2-8H,1H3,(H2,17,18)
InChIKeyQIRUUQZKUKWLGV-UHFFFAOYSA-N
MW269.28 g/mol
LogP3.45
Rot. Bonds2

About 3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine

3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine (PubChem CID 107662445) has the molecular formula C15H12FN3O and a molecular weight of 269.28 g/mol. Its IUPAC name is 3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine.

Molecular Properties

Compound Name3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine
PubChem CID107662445
Molecular FormulaC15H12FN3O
Molecular Weight269.28 g/mol
Exact Mass269.10
IUPAC Name3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine
SMILESCc1cccc(Oc2nc3ccccc3nc2N)c1F
InChIInChI=1S/C15H12FN3O/c1-9-5-4-8-12(13(9)16)20-15-14(17)18-10-6-2-3-7-11(10)19-15/h2-8H,1H3,(H2,17,18)
InChIKeyQIRUUQZKUKWLGV-UHFFFAOYSA-N
XLogP3.45
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-aminoquinoxalin-2-yl)oxy-4-methylbenzonitrile
CID 107662427
4-(3-aminoquinoxalin-2-yl)oxy-3-fluorobenzonitrile
CID 107669541
2-(2-fluoro-3-methylphenoxy)pyrimidin-4-amine
CID 107662449
6-(2,3-difluorophenoxy)-2,5-dimethylpyrimidin-4-amine
CID 80880333
4-(2-fluoro-3-methylphenoxy)pyrimidin-5-amine
CID 107655411
4-(2-fluoro-3-methylphenoxy)-6-methoxypyrimidin-5-amine
CID 107655439
3-(3-bromo-5-fluorophenoxy)quinoxalin-2-amine
CID 102988317
4-(2-methylphenoxy)quinazolin-2-amine
CID 80869397
3-(3-ethoxyphenoxy)quinoxalin-2-amine
CID 102988134
3-(2-bromo-4-chlorophenoxy)quinoxalin-2-amine
CID 102987884
[4-(2-fluoro-3-methylphenoxy)quinolin-2-yl]methanol
CID 107660035
2-fluoro-3-methoxyquinoxaline
CID 69493695

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine?
The IUPAC name of 3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine (CID 107662445) is 3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine.
What is the SMILES notation for 3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine?
The canonical SMILES for 3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine is Cc1cccc(Oc2nc3ccccc3nc2N)c1F.
What is the InChIKey of 3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine?
The InChIKey is QIRUUQZKUKWLGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O/c1-9-5-4-8-12(13(9)16)20-15-14(17)18-10-6-2-3-7-11(10)19-15/h2-8H,1H3,(H2,17,18).
What are the key properties of 3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine?
3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine has a molecular weight of 269.28 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoro-3-methylphenoxy)quinoxalin-2-amine is sourced from PubChem (CID 107662445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).