(2-oxo-1H-quinolin-3-yl) acetate

C11H9NO3 — CID 15133462

IUPAC(2-oxo-1H-quinolin-3-yl) acetate
SMILESCC(=O)Oc1cc2ccccc2[nH]c1=O
InChIInChI=1S/C11H9NO3/c1-7(13)15-10-6-8-4-2-3-5-9(8)12-11(10)14/h2-6H,1H3,(H,12,14)
InChIKeyUTIGEXXLPIATRW-UHFFFAOYSA-N
MW203.20 g/mol
LogP1.45
Rot. Bonds1

About (2-oxo-1H-quinolin-3-yl) acetate

(2-oxo-1H-quinolin-3-yl) acetate (PubChem CID 15133462) has the molecular formula C11H9NO3 and a molecular weight of 203.20 g/mol. Its IUPAC name is (2-oxo-1H-quinolin-3-yl) acetate.

Molecular Properties

Compound Name(2-oxo-1H-quinolin-3-yl) acetate
PubChem CID15133462
Molecular FormulaC11H9NO3
Molecular Weight203.20 g/mol
Exact Mass203.06
IUPAC Name(2-oxo-1H-quinolin-3-yl) acetate
SMILESCC(=O)Oc1cc2ccccc2[nH]c1=O
InChIInChI=1S/C11H9NO3/c1-7(13)15-10-6-8-4-2-3-5-9(8)12-11(10)14/h2-6H,1H3,(H,12,14)
InChIKeyUTIGEXXLPIATRW-UHFFFAOYSA-N
XLogP1.45
TPSA59.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Methylquinolin-2-ol
CID 69088
3-Hydroxyquinolin-2(1H)-one
CID 818159
3-methylquinolin-2(1H)-one
CID 440987
Viridicatin
CID 67206
3-Hydroxy-5-methylquinolin-2(1H)-one
CID 21622350
6-Fluoro-3-hydroxyquinolin-2(1H)-one
CID 23354375
3-Hydroxy-7-methylquinolin-2(1H)-one
CID 44157409
5-Ethyl-3-hydroxy-2(1H)-quinolinone
CID 44157410
7-Fluoro-3-hydroxyquinolin-2(1H)-one
CID 44157496
5-Fluoro-3-hydroxyquinolin-2(1H)-one
CID 44157497
3-Hydroxy-8-methylquinolin-2(1H)-one
CID 44157498
2,4-dimethyl-N-(2-methylphenyl)-6-oxopyran-3-carboxamide
CID 917461

Frequently Asked Questions

What is the IUPAC name of (2-oxo-1H-quinolin-3-yl) acetate?
The IUPAC name of (2-oxo-1H-quinolin-3-yl) acetate (CID 15133462) is (2-oxo-1H-quinolin-3-yl) acetate.
What is the SMILES notation for (2-oxo-1H-quinolin-3-yl) acetate?
The canonical SMILES for (2-oxo-1H-quinolin-3-yl) acetate is CC(=O)Oc1cc2ccccc2[nH]c1=O.
What is the InChIKey of (2-oxo-1H-quinolin-3-yl) acetate?
The InChIKey is UTIGEXXLPIATRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO3/c1-7(13)15-10-6-8-4-2-3-5-9(8)12-11(10)14/h2-6H,1H3,(H,12,14).
What are the key properties of (2-oxo-1H-quinolin-3-yl) acetate?
(2-oxo-1H-quinolin-3-yl) acetate has a molecular weight of 203.20 g/mol, XLogP of 1.45, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxo-1H-quinolin-3-yl) acetate is sourced from PubChem (CID 15133462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).