8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid

C15H13NO4 — CID 154127015

IUPAC8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid
SMILESCC=Cn1cc(C(=O)O)c(=O)c2cc3c(cc21)CCO3
InChIInChI=1S/C15H13NO4/c1-2-4-16-8-11(15(18)19)14(17)10-7-13-9(3-5-20-13)6-12(10)16/h2,4,6-8H,3,5H2,1H3,(H,18,19)
InChIKeyOOINXMDIGUFLAR-UHFFFAOYSA-N
MW271.27 g/mol
LogP2.13
Rot. Bonds2

About 8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid

8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid (PubChem CID 154127015) has the molecular formula C15H13NO4 and a molecular weight of 271.27 g/mol. Its IUPAC name is 8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid.

Molecular Properties

Compound Name8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid
PubChem CID154127015
Molecular FormulaC15H13NO4
Molecular Weight271.27 g/mol
Exact Mass271.08
IUPAC Name8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid
SMILESCC=Cn1cc(C(=O)O)c(=O)c2cc3c(cc21)CCO3
InChIInChI=1S/C15H13NO4/c1-2-4-16-8-11(15(18)19)14(17)10-7-13-9(3-5-20-13)6-12(10)16/h2,4,6-8H,3,5H2,1H3,(H,18,19)
InChIKeyOOINXMDIGUFLAR-UHFFFAOYSA-N
XLogP2.13
TPSA68.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethenyl-8-oxo-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid
CID 154091931
5-hydroxy-2,3-dihydro-1-benzofuran-6-carboxylic acid
CID 22159429
2-(6-methyl-2,3-dihydro-1-benzofuran-5-yl)acetic acid
CID 19098396
1-(6-fluoro-2,3-dihydro-1-benzofuran-5-yl)propan-2-one
CID 117284367
5-octyl-8-oxo-[1,3]dioxolo[4,5-g]quinoline-7-carboxylic acid
CID 142567545
5-[methoxycarbonyl(methyl)amino]-8-oxo-[1,3]dioxolo[4,5-g]quinoline-7-carboxylic acid
CID 70507084
ethane;7-fluoro-6-methyl-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid
CID 142486543
1-methyl-4-oxo-6-piperidin-1-ylquinoline-3-carboxylic acid
CID 82249897
5-(4-methoxyphenyl)-8-oxo-[1,3]dioxolo[4,5-g]quinoline-7-carboxylic acid
CID 70481800
6-ethyl-2,3-dihydro-[1,4]dioxino[2,3-f]indole-8-carboxylic acid
CID 83947489
10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13),11-tetraene-11-carboxylic acid
CID 21261005
6-(dimethylamino)-1-methyl-4-oxoquinoline-3-carboxylic acid
CID 82244225

Frequently Asked Questions

What is the IUPAC name of 8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid?
The IUPAC name of 8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid (CID 154127015) is 8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid.
What is the SMILES notation for 8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid?
The canonical SMILES for 8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid is CC=Cn1cc(C(=O)O)c(=O)c2cc3c(cc21)CCO3.
What is the InChIKey of 8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid?
The InChIKey is OOINXMDIGUFLAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO4/c1-2-4-16-8-11(15(18)19)14(17)10-7-13-9(3-5-20-13)6-12(10)16/h2,4,6-8H,3,5H2,1H3,(H,18,19).
What are the key properties of 8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid?
8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid has a molecular weight of 271.27 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-oxo-5-prop-1-enyl-2,3-dihydrofuro[2,3-g]quinoline-7-carboxylic acid is sourced from PubChem (CID 154127015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).