7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione

C7H7N3O2 — CID 144899506

IUPAC7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione
SMILESO=C1NCC(=O)N2CC=NC=C12
InChIInChI=1S/C7H7N3O2/c11-6-4-9-7(12)5-3-8-1-2-10(5)6/h1,3H,2,4H2,(H,9,12)
InChIKeyQARVQEHBNRPWIW-UHFFFAOYSA-N
MW165.15 g/mol
LogP-1.13
Rot. Bonds

About 7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione

7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione (PubChem CID 144899506) has the molecular formula C7H7N3O2 and a molecular weight of 165.15 g/mol. Its IUPAC name is 7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione.

Molecular Properties

Compound Name7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione
PubChem CID144899506
Molecular FormulaC7H7N3O2
Molecular Weight165.15 g/mol
Exact Mass165.05
IUPAC Name7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione
SMILESO=C1NCC(=O)N2CC=NC=C12
InChIInChI=1S/C7H7N3O2/c11-6-4-9-7(12)5-3-8-1-2-10(5)6/h1,3H,2,4H2,(H,9,12)
InChIKeyQARVQEHBNRPWIW-UHFFFAOYSA-N
XLogP-1.13
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.15
LogP ≤ 5-1.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione?
The IUPAC name of 7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione (CID 144899506) is 7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione.
What is the SMILES notation for 7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione?
The canonical SMILES for 7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione is O=C1NCC(=O)N2CC=NC=C12.
What is the InChIKey of 7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione?
The InChIKey is QARVQEHBNRPWIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2/c11-6-4-9-7(12)5-3-8-1-2-10(5)6/h1,3H,2,4H2,(H,9,12).
What are the key properties of 7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione?
7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione has a molecular weight of 165.15 g/mol, XLogP of -1.13, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dihydro-4H-pyrazino[1,2-a]pyrazine-6,9-dione is sourced from PubChem (CID 144899506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).