9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione

C14H9NO3 — CID 14176769

IUPAC9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione
SMILESCc1ccnc2c1C(=O)c1cccc(O)c1C2=O
InChIInChI=1S/C14H9NO3/c1-7-5-6-15-12-10(7)13(17)8-3-2-4-9(16)11(8)14(12)18/h2-6,16H,1H3
InChIKeyLZOSCGAASIXVKN-UHFFFAOYSA-N
MW239.23 g/mol
LogP1.87
Rot. Bonds

About 9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione

9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione (PubChem CID 14176769) has the molecular formula C14H9NO3 and a molecular weight of 239.23 g/mol. Its IUPAC name is 9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione.

Molecular Properties

Compound Name9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione
PubChem CID14176769
Molecular FormulaC14H9NO3
Molecular Weight239.23 g/mol
Exact Mass239.06
IUPAC Name9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione
SMILESCc1ccnc2c1C(=O)c1cccc(O)c1C2=O
InChIInChI=1S/C14H9NO3/c1-7-5-6-15-12-10(7)13(17)8-3-2-4-9(16)11(8)14(12)18/h2-6,16H,1H3
InChIKeyLZOSCGAASIXVKN-UHFFFAOYSA-N
XLogP1.87
TPSA67.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.23
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione?
The IUPAC name of 9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione (CID 14176769) is 9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione.
What is the SMILES notation for 9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione?
The canonical SMILES for 9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione is Cc1ccnc2c1C(=O)c1cccc(O)c1C2=O.
What is the InChIKey of 9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione?
The InChIKey is LZOSCGAASIXVKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9NO3/c1-7-5-6-15-12-10(7)13(17)8-3-2-4-9(16)11(8)14(12)18/h2-6,16H,1H3.
What are the key properties of 9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione?
9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione has a molecular weight of 239.23 g/mol, XLogP of 1.87, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-hydroxy-4-methylbenzo[g]quinoline-5,10-dione is sourced from PubChem (CID 14176769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).