5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid

C14H11NO4 — CID 154091931

IUPAC5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid
SMILESC=Cn1cc(C(=O)O)c(=O)c2cc3c(cc21)CCO3
InChIInChI=1S/C14H11NO4/c1-2-15-7-10(14(17)18)13(16)9-6-12-8(3-4-19-12)5-11(9)15/h2,5-7H,1,3-4H2,(H,17,18)
InChIKeyODWRTXNLLQLQJC-UHFFFAOYSA-N
MW257.25 g/mol
LogP1.74
Rot. Bonds2

About 5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid

5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid (PubChem CID 154091931) has the molecular formula C14H11NO4 and a molecular weight of 257.25 g/mol. Its IUPAC name is 5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid.

Molecular Properties

Compound Name5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid
PubChem CID154091931
Molecular FormulaC14H11NO4
Molecular Weight257.25 g/mol
Exact Mass257.07
IUPAC Name5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid
SMILESC=Cn1cc(C(=O)O)c(=O)c2cc3c(cc21)CCO3
InChIInChI=1S/C14H11NO4/c1-2-15-7-10(14(17)18)13(16)9-6-12-8(3-4-19-12)5-11(9)15/h2,5-7H,1,3-4H2,(H,17,18)
InChIKeyODWRTXNLLQLQJC-UHFFFAOYSA-N
XLogP1.74
TPSA68.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.25
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid?
The IUPAC name of 5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid (CID 154091931) is 5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid.
What is the SMILES notation for 5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid?
The canonical SMILES for 5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid is C=Cn1cc(C(=O)O)c(=O)c2cc3c(cc21)CCO3.
What is the InChIKey of 5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid?
The InChIKey is ODWRTXNLLQLQJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO4/c1-2-15-7-10(14(17)18)13(16)9-6-12-8(3-4-19-12)5-11(9)15/h2,5-7H,1,3-4H2,(H,17,18).
What are the key properties of 5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid?
5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid has a molecular weight of 257.25 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid is sourced from PubChem (CID 154091931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).