4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione

C11H7N3O2 — CID 14869090

IUPAC4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione
SMILESO=c1cnc2c([nH]1)c(=O)[nH]c1ccccc12
InChIInChI=1S/C11H7N3O2/c15-8-5-12-9-6-3-1-2-4-7(6)13-11(16)10(9)14-8/h1-5H,(H,13,16)(H,14,15)
InChIKeySNGQQEWJJNZXIM-UHFFFAOYSA-N
MW213.20 g/mol
LogP0.76
Rot. Bonds

About 4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione

4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione (PubChem CID 14869090) has the molecular formula C11H7N3O2 and a molecular weight of 213.20 g/mol. Its IUPAC name is 4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione.

Molecular Properties

Compound Name4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione
PubChem CID14869090
Molecular FormulaC11H7N3O2
Molecular Weight213.20 g/mol
Exact Mass213.05
IUPAC Name4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione
SMILESO=c1cnc2c([nH]1)c(=O)[nH]c1ccccc12
InChIInChI=1S/C11H7N3O2/c15-8-5-12-9-6-3-1-2-4-7(6)13-11(16)10(9)14-8/h1-5H,(H,13,16)(H,14,15)
InChIKeySNGQQEWJJNZXIM-UHFFFAOYSA-N
XLogP0.76
TPSA78.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.20
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

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CID 15355508
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CID 18386981
3,5-dihydro-2H-pyrazolo[3,4-c]quinoline-1,4-dione
CID 23366809
4H-diazeto[3,4-c]quinolin-3-one
CID 136619278
1H-quinoxalin-2-one;dihydrochloride
CID 141445979
5-bromo-1H-quinoxalin-2-one
CID 10537149
1,5-dihydro-[1,3]thiazolo[5,4-c]quinoline-2,4-dione
CID 90766437
5H-pyrido[3,2-c][1,5]naphthyridin-6-one
CID 11194941
10H-acridin-9-one
CID 22753806
3-methoxyphenanthro[9,10-b]pyrazine;4H-phenanthro[9,10-b]pyrazin-3-one;pyridine;hydrochloride
CID 158700382
8,11,17-triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,12,14,16-heptaen-9-one
CID 616556
1,5-dihydropyrazolo[4,5-c][1,5]naphthyridin-4-one
CID 136995246

Frequently Asked Questions

What is the IUPAC name of 4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione?
The IUPAC name of 4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione (CID 14869090) is 4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione.
What is the SMILES notation for 4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione?
The canonical SMILES for 4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione is O=c1cnc2c([nH]1)c(=O)[nH]c1ccccc12.
What is the InChIKey of 4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione?
The InChIKey is SNGQQEWJJNZXIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3O2/c15-8-5-12-9-6-3-1-2-4-7(6)13-11(16)10(9)14-8/h1-5H,(H,13,16)(H,14,15).
What are the key properties of 4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione?
4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione has a molecular weight of 213.20 g/mol, XLogP of 0.76, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dihydropyrazino[2,3-c]quinoline-3,5-dione is sourced from PubChem (CID 14869090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).