2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one

C12H6FN3O2 — CID 10198711

IUPAC2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one
SMILESO=c1oc(-c2ccccc2F)nc2nccnc12
InChIInChI=1S/C12H6FN3O2/c13-8-4-2-1-3-7(8)11-16-10-9(12(17)18-11)14-5-6-15-10/h1-6H
InChIKeyUDSVMNOFWJGGFJ-UHFFFAOYSA-N
MW243.20 g/mol
LogP1.78
Rot. Bonds1

About 2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one

2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one (PubChem CID 10198711) has the molecular formula C12H6FN3O2 and a molecular weight of 243.20 g/mol. Its IUPAC name is 2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one.

Molecular Properties

Compound Name2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one
PubChem CID10198711
Molecular FormulaC12H6FN3O2
Molecular Weight243.20 g/mol
Exact Mass243.04
IUPAC Name2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one
SMILESO=c1oc(-c2ccccc2F)nc2nccnc12
InChIInChI=1S/C12H6FN3O2/c13-8-4-2-1-3-7(8)11-16-10-9(12(17)18-11)14-5-6-15-10/h1-6H
InChIKeyUDSVMNOFWJGGFJ-UHFFFAOYSA-N
XLogP1.78
TPSA68.88 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.20
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

Benzyl pyrazine-2-carboxylate
CID 465059
[4-(Trifluoromethyl)phenyl]methyl pyrazine-2-carboxylate
CID 482666
Benzyl 3-amino-6-methylpyrazine-2-carboxylate
CID 317740
Benzyl 3-aminopyrazinecarboxylate
CID 108811
[3-(Trifluoromethyl)phenyl]methyl 5-methylpyrazine-2-carboxylate
CID 17435546
2-(2,6-Difluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one
CID 9860001
3-Amino-6-(4-fluorophenyl)-pyrazine-2-carboxylic acid methyl ester
CID 57428014
Methyl 2-[(4-fluorophenylmethylene)amino]pyrazine-3-carboxylate
CID 90010921
(4-Fluorophenyl)methyl 3-aminopyrazine-2-carboxylate
CID 16594676
[3-(Trifluoromethyl)phenyl]methyl 3-aminopyrazine-2-carboxylate
CID 16594678
(3-Fluorophenyl)methyl 3-aminopyrazine-2-carboxylate
CID 16594702
(2,3,4,5,6-Pentafluorophenyl)methyl 3-aminopyrazine-2-carboxylate
CID 16594720

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one?
The IUPAC name of 2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one (CID 10198711) is 2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one.
What is the SMILES notation for 2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one?
The canonical SMILES for 2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one is O=c1oc(-c2ccccc2F)nc2nccnc12.
What is the InChIKey of 2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one?
The InChIKey is UDSVMNOFWJGGFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6FN3O2/c13-8-4-2-1-3-7(8)11-16-10-9(12(17)18-11)14-5-6-15-10/h1-6H.
What are the key properties of 2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one?
2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one has a molecular weight of 243.20 g/mol, XLogP of 1.78, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)pyrazino[2,3-d][1,3]oxazin-4-one is sourced from PubChem (CID 10198711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).