4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one

C6H6N4O — CID 67153789

IUPAC4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one
SMILESO=C1C=NC2N=CC=NC2N1
InChIInChI=1S/C6H6N4O/c11-4-3-9-5-6(10-4)8-2-1-7-5/h1-3,5-6H,(H,10,11)
InChIKeyBDRVPHYMAUNGHQ-UHFFFAOYSA-N
MW150.14 g/mol
LogP-1.01
Rot. Bonds

About 4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one

4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one (PubChem CID 67153789) has the molecular formula C6H6N4O and a molecular weight of 150.14 g/mol. Its IUPAC name is 4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one.

Molecular Properties

Compound Name4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one
PubChem CID67153789
Molecular FormulaC6H6N4O
Molecular Weight150.14 g/mol
Exact Mass150.05
IUPAC Name4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one
SMILESO=C1C=NC2N=CC=NC2N1
InChIInChI=1S/C6H6N4O/c11-4-3-9-5-6(10-4)8-2-1-7-5/h1-3,5-6H,(H,10,11)
InChIKeyBDRVPHYMAUNGHQ-UHFFFAOYSA-N
XLogP-1.01
TPSA66.18 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.14
LogP ≤ 5-1.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one?
The IUPAC name of 4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one (CID 67153789) is 4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one.
What is the SMILES notation for 4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one?
The canonical SMILES for 4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one is O=C1C=NC2N=CC=NC2N1.
What is the InChIKey of 4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one?
The InChIKey is BDRVPHYMAUNGHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4O/c11-4-3-9-5-6(10-4)8-2-1-7-5/h1-3,5-6H,(H,10,11).
What are the key properties of 4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one?
4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one has a molecular weight of 150.14 g/mol, XLogP of -1.01, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4a,8a-dihydro-1H-pyrazino[2,3-b]pyrazin-2-one is sourced from PubChem (CID 67153789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).