2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone

C20H19NO4 — CID 162677128

IUPAC2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone
SMILESCOc1ccc2nc(C)cc(OCC(=O)c3ccccc3OC)c2c1
InChIInChI=1S/C20H19NO4/c1-13-10-20(16-11-14(23-2)8-9-17(16)21-13)25-12-18(22)15-6-4-5-7-19(15)24-3/h4-11H,12H2,1-3H3
InChIKeyJQYNDBANYMDYML-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.82
Rot. Bonds6

About 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone

2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone (PubChem CID 162677128) has the molecular formula C20H19NO4 and a molecular weight of 337.38 g/mol. Its IUPAC name is 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone.

Molecular Properties

Compound Name2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone
PubChem CID162677128
Molecular FormulaC20H19NO4
Molecular Weight337.38 g/mol
Exact Mass337.13
IUPAC Name2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone
SMILESCOc1ccc2nc(C)cc(OCC(=O)c3ccccc3OC)c2c1
InChIInChI=1S/C20H19NO4/c1-13-10-20(16-11-14(23-2)8-9-17(16)21-13)25-12-18(22)15-6-4-5-7-19(15)24-3/h4-11H,12H2,1-3H3
InChIKeyJQYNDBANYMDYML-UHFFFAOYSA-N
XLogP3.82
TPSA57.65 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone with MolForge

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Related Compounds

3-Methylbut-2-enyl 4-methoxy-8-(3-methylbut-2-enoxy)quinoline-2-carboxylate
CID 46910769
2,3-Dimethylphenyl 2-(4-methoxyphenyl)-4-quinolinecarboxylate
CID 1739332
3-Methylbut-2-enyl 4,8-bis(3-methylbut-2-enoxy)quinoline-2-carboxylate
CID 73602831
4-oxo-2-(3-(quinolin-2-ylmethoxy)phenyl)-4H-chromene-8-carboxylic acid
CID 10574284
2-[4-hydroxy-3-[(E)-3-[3-[(E)-2-quinolin-2-ylethenyl]phenyl]prop-2-enoyl]phenoxy]acetic acid
CID 10694890
3-hydroxy-4-[(E)-3-[3-(quinolin-2-ylmethoxy)phenyl]prop-2-enoyl]benzoic acid
CID 10836134
2-(3-Hexanoylphenoxymethyl)quinoline
CID 13560729
Ethyl 6-(benzyloxy)-2-methylquinoline-3-carboxylate
CID 697669
Methyl 2-(2-{2-[(2-methyl-8-quinolinyl)oxy]ethoxy}ethoxy)benzoate
CID 2184814
1-(3-Ethyl-2-methyl-quinolin-6-yl)-2-(3-methoxy-phenyl)-ethanone
CID 11232413
(2,3-Dihydro-benzo[1,4]dioxin-2-yl)-(3-ethyl-2-methyl-quinolin-6-yl)-methanone
CID 11232871
Chroman-3-yl-(3-ethyl-2-methyl-quinolin-6-yl)-methanone
CID 11461691

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone?
The IUPAC name of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone (CID 162677128) is 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone.
What is the SMILES notation for 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone?
The canonical SMILES for 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone is COc1ccc2nc(C)cc(OCC(=O)c3ccccc3OC)c2c1.
What is the InChIKey of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone?
The InChIKey is JQYNDBANYMDYML-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO4/c1-13-10-20(16-11-14(23-2)8-9-17(16)21-13)25-12-18(22)15-6-4-5-7-19(15)24-3/h4-11H,12H2,1-3H3.
What are the key properties of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone?
2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone has a molecular weight of 337.38 g/mol, XLogP of 3.82, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone is sourced from PubChem (CID 162677128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).