2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide

C23H21NO3 — CID 7717850

IUPAC2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide
SMILESCc1cccc(C)c1NC(=O)COc1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C23H21NO3/c1-16-7-6-8-17(2)22(16)24-21(25)15-27-20-13-11-19(12-14-20)23(26)18-9-4-3-5-10-18/h3-14H,15H2,1-2H3,(H,24,25)
InChIKeyDCLLMVHNCCHRNX-UHFFFAOYSA-N
MW359.43 g/mol
LogP4.55
Rot. Bonds6

About 2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide

2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide (PubChem CID 7717850) has the molecular formula C23H21NO3 and a molecular weight of 359.43 g/mol. Its IUPAC name is 2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide
PubChem CID7717850
Molecular FormulaC23H21NO3
Molecular Weight359.43 g/mol
Exact Mass359.15
IUPAC Name2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide
SMILESCc1cccc(C)c1NC(=O)COc1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C23H21NO3/c1-16-7-6-8-17(2)22(16)24-21(25)15-27-20-13-11-19(12-14-20)23(26)18-9-4-3-5-10-18/h3-14H,15H2,1-2H3,(H,24,25)
InChIKeyDCLLMVHNCCHRNX-UHFFFAOYSA-N
XLogP4.55
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-[4-(4-chlorobenzoyl)phenoxy]acetyl]amino]-N-(2,6-dimethylphenyl)acetamide
CID 31132082
N-(4-benzoylphenyl)-2-(4-methylphenoxy)acetamide
CID 837401
2-(4-acetamidophenoxy)-N-(2,6-dimethylphenyl)acetamide
CID 896754
N-(4-benzoylphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 1020136
[2-(2,6-dimethylanilino)-2-oxoethyl] 4-phenylmethoxybenzoate
CID 7264252
2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide
CID 7717727
methyl 3-[[2-(4-benzoylphenoxy)acetyl]amino]benzoate
CID 2592757
N-(2-methyl-6-propan-2-ylphenyl)-2-(4-phenylphenoxy)acetamide
CID 7790431
N-(2,6-dimethylphenyl)-2-[[2-(4-methoxyphenoxy)acetyl]amino]acetamide
CID 26904107
methyl 4-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethoxy]benzoate
CID 7667630
N-(2,6-dimethylphenyl)-2-[4-[(2-methylphenyl)sulfamoyl]phenoxy]acetamide
CID 3571007
2-(4-benzoylphenoxy)-N-[(2-methylpropan-2-yl)oxy]acetamide
CID 75435846

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide?
The IUPAC name of 2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide (CID 7717850) is 2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide?
The canonical SMILES for 2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide is Cc1cccc(C)c1NC(=O)COc1ccc(C(=O)c2ccccc2)cc1.
What is the InChIKey of 2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide?
The InChIKey is DCLLMVHNCCHRNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO3/c1-16-7-6-8-17(2)22(16)24-21(25)15-27-20-13-11-19(12-14-20)23(26)18-9-4-3-5-10-18/h3-14H,15H2,1-2H3,(H,24,25).
What are the key properties of 2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide?
2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide has a molecular weight of 359.43 g/mol, XLogP of 4.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide is sourced from PubChem (CID 7717850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).