N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide

C21H22N2O3 — CID 112787483

IUPACN-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
SMILESCCc1ccc(NC(=O)COc2cc(C)nc3ccc(OC)cc23)cc1
InChIInChI=1S/C21H22N2O3/c1-4-15-5-7-16(8-6-15)23-21(24)13-26-20-11-14(2)22-19-10-9-17(25-3)12-18(19)20/h5-12H,4,13H2,1-3H3,(H,23,24)
InChIKeyCKZTYLNUFBOQJU-UHFFFAOYSA-N
MW350.42 g/mol
LogP4.13
Rot. Bonds6

About N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide

N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide (PubChem CID 112787483) has the molecular formula C21H22N2O3 and a molecular weight of 350.42 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
PubChem CID112787483
Molecular FormulaC21H22N2O3
Molecular Weight350.42 g/mol
Exact Mass350.16
IUPAC NameN-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
SMILESCCc1ccc(NC(=O)COc2cc(C)nc3ccc(OC)cc23)cc1
InChIInChI=1S/C21H22N2O3/c1-4-15-5-7-16(8-6-15)23-21(24)13-26-20-11-14(2)22-19-10-9-17(25-3)12-18(19)20/h5-12H,4,13H2,1-3H3,(H,23,24)
InChIKeyCKZTYLNUFBOQJU-UHFFFAOYSA-N
XLogP4.13
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Ethacridine
CID 2017
alpha-Pentyl-3-(2-quinolinylmethoxy)benzenemethanol
CID 5059
2-[(6-methoxy-2-methyl-4-quinolyl)oxy]-N-(2-methoxyphenyl)acetamide
CID 70685044
6-Ethoxy-2-methylquinoline
CID 81118
2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(4-pentylphenyl)acetamide
CID 137653074
N-[(2-methylquinolin-4-yl)methyl]-2-(4-nitrophenoxy)acetamide
CID 1503106
N-benzyl-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
CID 70682976
N-(4-ethoxyphenyl)-2,8-dimethylquinolin-4-amine
CID 715734
N-(4-ethoxyphenyl)-2,6-dimethylquinolin-4-amine
CID 798218
1-Fluoro-3-(2-(4-(methylamino)phenyl)quinolin-6-yloxy)propan-2-ol
CID 69620381
4-[6-(2-Fluoroethoxy)-2-quinolinyl]benzenamine
CID 76023983
N-Benzyl-2-(6-bromo-2-methyl-quinolin-4-yloxy)-acetamide
CID 70691354

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide?
The IUPAC name of N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide (CID 112787483) is N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide?
The canonical SMILES for N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide is CCc1ccc(NC(=O)COc2cc(C)nc3ccc(OC)cc23)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide?
The InChIKey is CKZTYLNUFBOQJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O3/c1-4-15-5-7-16(8-6-15)23-21(24)13-26-20-11-14(2)22-19-10-9-17(25-3)12-18(19)20/h5-12H,4,13H2,1-3H3,(H,23,24).
What are the key properties of N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide?
N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide has a molecular weight of 350.42 g/mol, XLogP of 4.13, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide is sourced from PubChem (CID 112787483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).