4-methylpyrazino[2,3-b][1,4]oxazin-3-one

C7H7N3O2 — CID 130251557

IUPAC4-methylpyrazino[2,3-b][1,4]oxazin-3-one
SMILESCN1C(=O)COc2nccnc21
InChIInChI=1S/C7H7N3O2/c1-10-5(11)4-12-7-6(10)8-2-3-9-7/h2-3H,4H2,1H3
InChIKeyFUFLMQIOCVPAHO-UHFFFAOYSA-N
MW165.15 g/mol
LogP-0.17
Rot. Bonds

About 4-methylpyrazino[2,3-b][1,4]oxazin-3-one

4-methylpyrazino[2,3-b][1,4]oxazin-3-one (PubChem CID 130251557) has the molecular formula C7H7N3O2 and a molecular weight of 165.15 g/mol. Its IUPAC name is 4-methylpyrazino[2,3-b][1,4]oxazin-3-one.

Molecular Properties

Compound Name4-methylpyrazino[2,3-b][1,4]oxazin-3-one
PubChem CID130251557
Molecular FormulaC7H7N3O2
Molecular Weight165.15 g/mol
Exact Mass165.05
IUPAC Name4-methylpyrazino[2,3-b][1,4]oxazin-3-one
SMILESCN1C(=O)COc2nccnc21
InChIInChI=1S/C7H7N3O2/c1-10-5(11)4-12-7-6(10)8-2-3-9-7/h2-3H,4H2,1H3
InChIKeyFUFLMQIOCVPAHO-UHFFFAOYSA-N
XLogP-0.17
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.15
LogP ≤ 5-0.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methylpyrazino[2,3-b][1,4]oxazin-3-one?
The IUPAC name of 4-methylpyrazino[2,3-b][1,4]oxazin-3-one (CID 130251557) is 4-methylpyrazino[2,3-b][1,4]oxazin-3-one.
What is the SMILES notation for 4-methylpyrazino[2,3-b][1,4]oxazin-3-one?
The canonical SMILES for 4-methylpyrazino[2,3-b][1,4]oxazin-3-one is CN1C(=O)COc2nccnc21.
What is the InChIKey of 4-methylpyrazino[2,3-b][1,4]oxazin-3-one?
The InChIKey is FUFLMQIOCVPAHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2/c1-10-5(11)4-12-7-6(10)8-2-3-9-7/h2-3H,4H2,1H3.
What are the key properties of 4-methylpyrazino[2,3-b][1,4]oxazin-3-one?
4-methylpyrazino[2,3-b][1,4]oxazin-3-one has a molecular weight of 165.15 g/mol, XLogP of -0.17, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylpyrazino[2,3-b][1,4]oxazin-3-one is sourced from PubChem (CID 130251557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).