2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid

C11H10FNO4 — CID 114939875

IUPAC2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid
SMILESO=C1CCc2ccc(OC(F)C(=O)O)cc2N1
InChIInChI=1S/C11H10FNO4/c12-10(11(15)16)17-7-3-1-6-2-4-9(14)13-8(6)5-7/h1,3,5,10H,2,4H2,(H,13,14)(H,15,16)
InChIKeyQPIDTEVWHKVWLG-UHFFFAOYSA-N
MW239.20 g/mol
LogP1.33
Rot. Bonds3

About 2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid

2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid (PubChem CID 114939875) has the molecular formula C11H10FNO4 and a molecular weight of 239.20 g/mol. Its IUPAC name is 2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid.

Molecular Properties

Compound Name2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid
PubChem CID114939875
Molecular FormulaC11H10FNO4
Molecular Weight239.20 g/mol
Exact Mass239.06
IUPAC Name2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid
SMILESO=C1CCc2ccc(OC(F)C(=O)O)cc2N1
InChIInChI=1S/C11H10FNO4/c12-10(11(15)16)17-7-3-1-6-2-4-9(14)13-8(6)5-7/h1,3,5,10H,2,4H2,(H,13,14)(H,15,16)
InChIKeyQPIDTEVWHKVWLG-UHFFFAOYSA-N
XLogP1.33
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.20
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

7-(2-oxopropoxy)-3,4-dihydro-1H-quinolin-2-one
CID 112704281
pentyl 2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]butanoate
CID 12821891
N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide
CID 114939986
7-(3-bromo-2-hydroxypropoxy)-3,4-dihydro-1H-quinolin-2-one
CID 114939907
7-fluoro-2-oxo-3,4-dihydro-1H-quinoline-6-carboxylic acid
CID 43453281
5-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxymethyl]thiophene-2-carboxylic acid
CID 114939878
(2-oxo-3,4-dihydro-1H-quinolin-7-yl) 1H-pyrazole-5-carboxylate
CID 99823234
(2-oxo-3,4-dihydro-1H-quinolin-7-yl) benzenesulfonate
CID 131868830
N-(3-methylbutan-2-yl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetamide
CID 114940002
2-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)acetic acid
CID 59398387
7-cycloheptyloxy-3,4-dihydro-1H-quinolin-2-one
CID 114940056
3-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxymethyl]thiophene-2-carboxylic acid
CID 114939866

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid?
The IUPAC name of 2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid (CID 114939875) is 2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid.
What is the SMILES notation for 2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid?
The canonical SMILES for 2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid is O=C1CCc2ccc(OC(F)C(=O)O)cc2N1.
What is the InChIKey of 2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid?
The InChIKey is QPIDTEVWHKVWLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNO4/c12-10(11(15)16)17-7-3-1-6-2-4-9(14)13-8(6)5-7/h1,3,5,10H,2,4H2,(H,13,14)(H,15,16).
What are the key properties of 2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid?
2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid has a molecular weight of 239.20 g/mol, XLogP of 1.33, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid is sourced from PubChem (CID 114939875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).