2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide

C22H24N2O3 — CID 169411482

IUPAC2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide
SMILESCCOc1ccc(-c2cc(C)c3cc(CC(=O)NC)ccc3n2)cc1OC
InChIInChI=1S/C22H24N2O3/c1-5-27-20-9-7-16(13-21(20)26-4)19-10-14(2)17-11-15(12-22(25)23-3)6-8-18(17)24-19/h6-11,13H,5,12H2,1-4H3,(H,23,25)
InChIKeyIFGXDANHNQZPLG-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.91
Rot. Bonds6

About 2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide

2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide (PubChem CID 169411482) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is 2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide.

Molecular Properties

Compound Name2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide
PubChem CID169411482
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC Name2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide
SMILESCCOc1ccc(-c2cc(C)c3cc(CC(=O)NC)ccc3n2)cc1OC
InChIInChI=1S/C22H24N2O3/c1-5-27-20-9-7-16(13-21(20)26-4)19-10-14(2)17-11-15(12-22(25)23-3)6-8-18(17)24-19/h6-11,13H,5,12H2,1-4H3,(H,23,25)
InChIKeyIFGXDANHNQZPLG-UHFFFAOYSA-N
XLogP3.91
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(2,5-dimethoxy-4-methylsulfanylphenyl)-4-methylquinolin-6-yl]-N-methylacetamide
CID 169414898
N-methyl-2-[4-methyl-2-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)quinolin-6-yl]acetamide
CID 170508487
2-[2-[3-(hydroxymethyl)-4-propoxyphenyl]-4-methylquinolin-6-yl]-N,N-dimethylacetamide
CID 169412700
3-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-methylpropanamide
CID 2986039
2-[2-(2-fluoro-6-methoxyphenyl)-4-methylquinolin-7-yl]-N-methylacetamide
CID 169414091
2-[4-cyclopropyl-2-(3,4-dimethoxyphenyl)quinolin-6-yl]acetamide
CID 170510978
2-[2-(5-hydroxy-2-methoxyphenyl)-4-methylquinolin-6-yl]-N,N-dimethylacetamide
CID 169412688
N-cyclopropyl-2-[2-(4-fluorophenyl)-4-methylquinolin-6-yl]acetamide
CID 170505736
ethyl 2-[3-(3,4-dimethoxyphenyl)benzo[f]quinolin-1-yl]acetate
CID 3648105
2-[2-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-4-methylquinolin-6-yl]-N-methylacetamide
CID 169420696
3-(3-methoxy-4-phenylmethoxyphenyl)-1-methylbenzo[f]quinoline
CID 3111565
N-[3-(3,4-dimethylphenyl)propyl]-2-(4-ethoxy-3-methoxyphenyl)acetamide
CID 143080123

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide?
The IUPAC name of 2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide (CID 169411482) is 2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide.
What is the SMILES notation for 2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide?
The canonical SMILES for 2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide is CCOc1ccc(-c2cc(C)c3cc(CC(=O)NC)ccc3n2)cc1OC.
What is the InChIKey of 2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide?
The InChIKey is IFGXDANHNQZPLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-5-27-20-9-7-16(13-21(20)26-4)19-10-14(2)17-11-15(12-22(25)23-3)6-8-18(17)24-19/h6-11,13H,5,12H2,1-4H3,(H,23,25).
What are the key properties of 2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide?
2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide has a molecular weight of 364.45 g/mol, XLogP of 3.91, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-ethoxy-3-methoxyphenyl)-4-methylquinolin-6-yl]-N-methylacetamide is sourced from PubChem (CID 169411482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).