8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one

C20H21NO4 — CID 46302499

IUPAC8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one
SMILESCOc1ccc(OCCn2c(=O)cc(C)c3cccc(OC)c32)cc1
InChIInChI=1S/C20H21NO4/c1-14-13-19(22)21(20-17(14)5-4-6-18(20)24-3)11-12-25-16-9-7-15(23-2)8-10-16/h4-10,13H,11-12H2,1-3H3
InChIKeyIAXYKWXYQTXVJC-UHFFFAOYSA-N
MW339.39 g/mol
LogP3.41
Rot. Bonds6

About 8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one

8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one (PubChem CID 46302499) has the molecular formula C20H21NO4 and a molecular weight of 339.39 g/mol. Its IUPAC name is 8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one.

Molecular Properties

Compound Name8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one
PubChem CID46302499
Molecular FormulaC20H21NO4
Molecular Weight339.39 g/mol
Exact Mass339.15
IUPAC Name8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one
SMILESCOc1ccc(OCCn2c(=O)cc(C)c3cccc(OC)c32)cc1
InChIInChI=1S/C20H21NO4/c1-14-13-19(22)21(20-17(14)5-4-6-18(20)24-3)11-12-25-16-9-7-15(23-2)8-10-16/h4-10,13H,11-12H2,1-3H3
InChIKeyIAXYKWXYQTXVJC-UHFFFAOYSA-N
XLogP3.41
TPSA49.69 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.39
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

8-methoxy-4-methyl-1-propylquinolin-2-one
CID 39768477
8-methoxy-4-methyl-1-(naphthalen-1-ylmethyl)quinolin-2-one
CID 39768466
4,8-dimethyl-1-[4-(4-methylphenoxy)butyl]quinolin-2-one
CID 39768203
N-(2,6-dimethylphenyl)-3-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39765352
N-(3,4-dimethylphenyl)-3-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39765354
1-[2-(4-chlorophenoxy)ethyl]-4-methylquinolin-2-one
CID 39768066
N-(2,3-dimethylphenyl)-3-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39765349
N-(4-chlorophenyl)-2-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)acetamide
CID 46302523
3-[2-(2,6-dimethoxyphenoxy)ethyl]-2-(4-methoxyphenyl)quinazolin-4-one
CID 3534114
8-chloro-1-[2-(4-methoxyphenoxy)ethyl]-3,1-benzoxazine-2,4-dione
CID 18803593
4-methyl-1-[4-(4-methylphenoxy)butyl]quinolin-2-one
CID 39768022
4,6,8-trimethyl-1-(4-phenoxybutyl)quinolin-2-one
CID 39768400

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one?
The IUPAC name of 8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one (CID 46302499) is 8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one.
What is the SMILES notation for 8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one?
The canonical SMILES for 8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one is COc1ccc(OCCn2c(=O)cc(C)c3cccc(OC)c32)cc1.
What is the InChIKey of 8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one?
The InChIKey is IAXYKWXYQTXVJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO4/c1-14-13-19(22)21(20-17(14)5-4-6-18(20)24-3)11-12-25-16-9-7-15(23-2)8-10-16/h4-10,13H,11-12H2,1-3H3.
What are the key properties of 8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one?
8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one has a molecular weight of 339.39 g/mol, XLogP of 3.41, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-1-[2-(4-methoxyphenoxy)ethyl]-4-methylquinolin-2-one is sourced from PubChem (CID 46302499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).