3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone

C14H10N2O4 — CID 19701069

IUPAC3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone
SMILESCCc1cc2c([nH]c1=O)C(=O)c1[nH]c(=O)ccc1C2=O
InChIInChI=1S/C14H10N2O4/c1-2-6-5-8-11(16-14(6)20)13(19)10-7(12(8)18)3-4-9(17)15-10/h3-5H,2H2,1H3,(H,15,17)(H,16,20)
InChIKeyOMFUXOUHQOXHRN-UHFFFAOYSA-N
MW270.24 g/mol
LogP0.40
Rot. Bonds1

About 3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone

3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone (PubChem CID 19701069) has the molecular formula C14H10N2O4 and a molecular weight of 270.24 g/mol. Its IUPAC name is 3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone.

Molecular Properties

Compound Name3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone
PubChem CID19701069
Molecular FormulaC14H10N2O4
Molecular Weight270.24 g/mol
Exact Mass270.06
IUPAC Name3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone
SMILESCCc1cc2c([nH]c1=O)C(=O)c1[nH]c(=O)ccc1C2=O
InChIInChI=1S/C14H10N2O4/c1-2-6-5-8-11(16-14(6)20)13(19)10-7(12(8)18)3-4-9(17)15-10/h3-5H,2H2,1H3,(H,15,17)(H,16,20)
InChIKeyOMFUXOUHQOXHRN-UHFFFAOYSA-N
XLogP0.40
TPSA99.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.24
LogP ≤ 50.40
H-Bond Donors ≤ 52
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 3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone?
The IUPAC name of 3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone (CID 19701069) is 3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone.
What is the SMILES notation for 3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone?
The canonical SMILES for 3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone is CCc1cc2c([nH]c1=O)C(=O)c1[nH]c(=O)ccc1C2=O.
What is the InChIKey of 3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone?
The InChIKey is OMFUXOUHQOXHRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O4/c1-2-6-5-8-11(16-14(6)20)13(19)10-7(12(8)18)3-4-9(17)15-10/h3-5H,2H2,1H3,(H,15,17)(H,16,20).
What are the key properties of 3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone?
3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone has a molecular weight of 270.24 g/mol, XLogP of 0.40, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1,9-dihydropyrido[3,2-g]quinoline-2,5,8,10-tetrone is sourced from PubChem (CID 19701069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).