N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide

C27H26N2O3 — CID 155925750

IUPACN-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide
SMILESCc1cc(C)cc(NC(=O)COc2cc(C)nc3ccc(OCc4ccccc4)cc23)c1
InChIInChI=1S/C27H26N2O3/c1-18-11-19(2)13-22(12-18)29-27(30)17-32-26-14-20(3)28-25-10-9-23(15-24(25)26)31-16-21-7-5-4-6-8-21/h4-15H,16-17H2,1-3H3,(H,29,30)
InChIKeyWXDUPSTXUXYOEO-UHFFFAOYSA-N
MW426.52 g/mol
LogP5.76
Rot. Bonds7

About N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide

N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide (PubChem CID 155925750) has the molecular formula C27H26N2O3 and a molecular weight of 426.52 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide
PubChem CID155925750
Molecular FormulaC27H26N2O3
Molecular Weight426.52 g/mol
Exact Mass426.19
IUPAC NameN-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide
SMILESCc1cc(C)cc(NC(=O)COc2cc(C)nc3ccc(OCc4ccccc4)cc23)c1
InChIInChI=1S/C27H26N2O3/c1-18-11-19(2)13-22(12-18)29-27(30)17-32-26-14-20(3)28-25-10-9-23(15-24(25)26)31-16-21-7-5-4-6-8-21/h4-15H,16-17H2,1-3H3,(H,29,30)
InChIKeyWXDUPSTXUXYOEO-UHFFFAOYSA-N
XLogP5.76
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.52
LogP ≤ 55.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6,7-dimethoxy-2-methylquinolin-4-yl)oxy-N-(3,5-dimethylphenyl)acetamide
CID 155924029
[2-(3,5-dimethylanilino)-2-oxoethyl] 3-phenylmethoxybenzoate
CID 7240119
2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-[(4-methoxyphenyl)methyl]acetamide
CID 112787491
2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 112787517
N-(3-methoxyphenyl)-2-(2-methylquinolin-4-yl)oxyacetamide
CID 99835658
2-[6-[2-[4-[[2-(6-methoxy-2-methylquinolin-4-yl)oxyacetyl]amino]-2-methylphenyl]ethoxy]-2-methylquinolin-4-yl]oxy-N-(4-methylphenyl)acetamide
CID 145208170
2-(2-methoxy-4-methylphenoxy)-N-(4-phenylmethoxyphenyl)acetamide
CID 2095965
2-(3,4-dimethylphenoxy)-N-(4-phenylmethoxyphenyl)acetamide
CID 4947508
2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone
CID 162664426
2-methyl-6-phenylmethoxyquinoline-4-carbothioamide
CID 82574282
2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide
CID 1352449
N-(3,5-dimethylphenyl)-2-(2-methylquinazolin-4-yl)oxyacetamide
CID 46391582

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide?
The IUPAC name of N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide (CID 155925750) is N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide is Cc1cc(C)cc(NC(=O)COc2cc(C)nc3ccc(OCc4ccccc4)cc23)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide?
The InChIKey is WXDUPSTXUXYOEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26N2O3/c1-18-11-19(2)13-22(12-18)29-27(30)17-32-26-14-20(3)28-25-10-9-23(15-24(25)26)31-16-21-7-5-4-6-8-21/h4-15H,16-17H2,1-3H3,(H,29,30).
What are the key properties of N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide?
N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide has a molecular weight of 426.52 g/mol, XLogP of 5.76, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2-(2-methyl-6-phenylmethoxyquinolin-4-yl)oxyacetamide is sourced from PubChem (CID 155925750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).