6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one

C18H15NO4 — CID 121005750

IUPAC6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one
SMILESCOc1ccc(C(=O)COc2ccc3[nH]c(=O)ccc3c2)cc1
InChIInChI=1S/C18H15NO4/c1-22-14-5-2-12(3-6-14)17(20)11-23-15-7-8-16-13(10-15)4-9-18(21)19-16/h2-10H,11H2,1H3,(H,19,21)
InChIKeyKSLPJQSTTGMLBL-UHFFFAOYSA-N
MW309.32 g/mol
LogP2.80
Rot. Bonds5

About 6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one

6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one (PubChem CID 121005750) has the molecular formula C18H15NO4 and a molecular weight of 309.32 g/mol. Its IUPAC name is 6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one
PubChem CID121005750
Molecular FormulaC18H15NO4
Molecular Weight309.32 g/mol
Exact Mass309.10
IUPAC Name6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one
SMILESCOc1ccc(C(=O)COc2ccc3[nH]c(=O)ccc3c2)cc1
InChIInChI=1S/C18H15NO4/c1-22-14-5-2-12(3-6-14)17(20)11-23-15-7-8-16-13(10-15)4-9-18(21)19-16/h2-10H,11H2,1H3,(H,19,21)
InChIKeyKSLPJQSTTGMLBL-UHFFFAOYSA-N
XLogP2.80
TPSA68.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.32
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one
CID 15831364
6-[(4-methoxyphenyl)methyl]-1H-quinolin-2-one
CID 70082190
6-(2-chloroethoxy)-1H-quinolin-2-one
CID 20540025
2-(3-fluorophenoxy)-1-(4-methoxyphenyl)ethanone
CID 43413421
6-(cyclopropylmethoxy)-1H-quinolin-2-one
CID 68861342
ethyl 3-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanoate
CID 20563580
2-chloro-4-[2-(4-methoxyphenyl)-2-oxoethoxy]benzonitrile
CID 102674505
1-(4-chlorophenyl)-2-(3-methoxyphenoxy)ethanone
CID 43412672
CID 157177640
CID 157177640
3-(2-bromoacetyl)-7-methoxy-1H-quinolin-2-one
CID 22638606
7-ethoxy-1H-quinolin-2-one
CID 123474288
N-cyclopropyl-N-ethyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide
CID 13112648

Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one?
The IUPAC name of 6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one (CID 121005750) is 6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one.
What is the SMILES notation for 6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one?
The canonical SMILES for 6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one is COc1ccc(C(=O)COc2ccc3[nH]c(=O)ccc3c2)cc1.
What is the InChIKey of 6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one?
The InChIKey is KSLPJQSTTGMLBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO4/c1-22-14-5-2-12(3-6-14)17(20)11-23-15-7-8-16-13(10-15)4-9-18(21)19-16/h2-10H,11H2,1H3,(H,19,21).
What are the key properties of 6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one?
6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one has a molecular weight of 309.32 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one is sourced from PubChem (CID 121005750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).