7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one

C18H15NO4 — CID 15831364

IUPAC7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one
SMILESCOc1ccc(C(=O)COc2ccc3ccc(=O)[nH]c3c2)cc1
InChIInChI=1S/C18H15NO4/c1-22-14-6-3-13(4-7-14)17(20)11-23-15-8-2-12-5-9-18(21)19-16(12)10-15/h2-10H,11H2,1H3,(H,19,21)
InChIKeySCSDJOFWVYYQCA-UHFFFAOYSA-N
MW309.32 g/mol
LogP2.80
Rot. Bonds5

About 7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one

7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one (PubChem CID 15831364) has the molecular formula C18H15NO4 and a molecular weight of 309.32 g/mol. Its IUPAC name is 7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one.

Molecular Properties

Compound Name7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one
PubChem CID15831364
Molecular FormulaC18H15NO4
Molecular Weight309.32 g/mol
Exact Mass309.10
IUPAC Name7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one
SMILESCOc1ccc(C(=O)COc2ccc3ccc(=O)[nH]c3c2)cc1
InChIInChI=1S/C18H15NO4/c1-22-14-6-3-13(4-7-14)17(20)11-23-15-8-2-12-5-9-18(21)19-16(12)10-15/h2-10H,11H2,1H3,(H,19,21)
InChIKeySCSDJOFWVYYQCA-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

6-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one
CID 121005750
7-ethoxy-1H-quinolin-2-one
CID 123474288
2-(3-fluorophenoxy)-1-(4-methoxyphenyl)ethanone
CID 43413421
ethane;7-pentoxy-1H-quinolin-2-one
CID 144829550
3-(2-bromoacetyl)-7-methoxy-1H-quinolin-2-one
CID 22638606
7-[2-hydroxy-3-(2-hydroxy-3-methoxypropoxy)propoxy]-1H-quinolin-2-one
CID 177262317
2-chloro-4-[2-(4-methoxyphenyl)-2-oxoethoxy]benzonitrile
CID 102674505
ethyl 2-oxo-1H-quinoline-7-carboxylate
CID 15091487
7-[5-(hydroxyamino)pentoxy]-1H-quinolin-2-one
CID 118707059
3-[2-(4-methoxyphenyl)-2-oxoethoxy]-8,9,10,11-tetrahydro-7H-cyclohepta[c]chromen-6-one
CID 4617441
1-(4-chlorophenyl)-2-(3-methoxyphenoxy)ethanone
CID 43412672
7-(4-methoxy-2-pyridinyl)-1H-quinolin-2-one
CID 18667592

Frequently Asked Questions

What is the IUPAC name of 7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one?
The IUPAC name of 7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one (CID 15831364) is 7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one.
What is the SMILES notation for 7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one?
The canonical SMILES for 7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one is COc1ccc(C(=O)COc2ccc3ccc(=O)[nH]c3c2)cc1.
What is the InChIKey of 7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one?
The InChIKey is SCSDJOFWVYYQCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO4/c1-22-14-6-3-13(4-7-14)17(20)11-23-15-8-2-12-5-9-18(21)19-16(12)10-15/h2-10H,11H2,1H3,(H,19,21).
What are the key properties of 7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one?
7-[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 7-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-quinolin-2-one is sourced from PubChem (CID 15831364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).