1,4-dihydrobenzo[g]quinoxaline-2,3-dione

C12H8N2O2 — CID 10822409

IUPAC1,4-dihydrobenzo[g]quinoxaline-2,3-dione
SMILESO=c1[nH]c2cc3ccccc3cc2[nH]c1=O
InChIInChI=1S/C12H8N2O2/c15-11-12(16)14-10-6-8-4-2-1-3-7(8)5-9(10)13-11/h1-6H,(H,13,15)(H,14,16)
InChIKeyKLBLIQLOPBRDNC-UHFFFAOYSA-N
MW212.21 g/mol
LogP1.37
Rot. Bonds

About 1,4-dihydrobenzo[g]quinoxaline-2,3-dione

1,4-dihydrobenzo[g]quinoxaline-2,3-dione (PubChem CID 10822409) has the molecular formula C12H8N2O2 and a molecular weight of 212.21 g/mol. Its IUPAC name is 1,4-dihydrobenzo[g]quinoxaline-2,3-dione.

Molecular Properties

Compound Name1,4-dihydrobenzo[g]quinoxaline-2,3-dione
PubChem CID10822409
Molecular FormulaC12H8N2O2
Molecular Weight212.21 g/mol
Exact Mass212.06
IUPAC Name1,4-dihydrobenzo[g]quinoxaline-2,3-dione
SMILESO=c1[nH]c2cc3ccccc3cc2[nH]c1=O
InChIInChI=1S/C12H8N2O2/c15-11-12(16)14-10-6-8-4-2-1-3-7(8)5-9(10)13-11/h1-6H,(H,13,15)(H,14,16)
InChIKeyKLBLIQLOPBRDNC-UHFFFAOYSA-N
XLogP1.37
TPSA65.72 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,4-dihydrobenzo[g]quinoxaline-2,3-dione?
The IUPAC name of 1,4-dihydrobenzo[g]quinoxaline-2,3-dione (CID 10822409) is 1,4-dihydrobenzo[g]quinoxaline-2,3-dione.
What is the SMILES notation for 1,4-dihydrobenzo[g]quinoxaline-2,3-dione?
The canonical SMILES for 1,4-dihydrobenzo[g]quinoxaline-2,3-dione is O=c1[nH]c2cc3ccccc3cc2[nH]c1=O.
What is the InChIKey of 1,4-dihydrobenzo[g]quinoxaline-2,3-dione?
The InChIKey is KLBLIQLOPBRDNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2O2/c15-11-12(16)14-10-6-8-4-2-1-3-7(8)5-9(10)13-11/h1-6H,(H,13,15)(H,14,16).
What are the key properties of 1,4-dihydrobenzo[g]quinoxaline-2,3-dione?
1,4-dihydrobenzo[g]quinoxaline-2,3-dione has a molecular weight of 212.21 g/mol, XLogP of 1.37, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dihydrobenzo[g]quinoxaline-2,3-dione is sourced from PubChem (CID 10822409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).