2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide

C22H18ClNO3 — CID 7717727

IUPAC2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide
SMILESCc1cc(Cl)ccc1NC(=O)COc1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C22H18ClNO3/c1-15-13-18(23)9-12-20(15)24-21(25)14-27-19-10-7-17(8-11-19)22(26)16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,24,25)
InChIKeyTZXHYHIIFPJUFI-UHFFFAOYSA-N
MW379.84 g/mol
LogP4.90
Rot. Bonds6

About 2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide

2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide (PubChem CID 7717727) has the molecular formula C22H18ClNO3 and a molecular weight of 379.84 g/mol. Its IUPAC name is 2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide
PubChem CID7717727
Molecular FormulaC22H18ClNO3
Molecular Weight379.84 g/mol
Exact Mass379.10
IUPAC Name2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide
SMILESCc1cc(Cl)ccc1NC(=O)COc1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C22H18ClNO3/c1-15-13-18(23)9-12-20(15)24-21(25)14-27-19-10-7-17(8-11-19)22(26)16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,24,25)
InChIKeyTZXHYHIIFPJUFI-UHFFFAOYSA-N
XLogP4.90
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.84
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chloro-2-methylphenyl)-2-(3,4-dimethylphenoxy)acetamide
CID 1122557
N-(4-chloro-2-methylphenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
CID 19174143
N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide
CID 2707661
N-(4-chloro-2-methylphenyl)-2-(3,5-dichlorophenoxy)acetamide
CID 7467092
N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide
CID 19169901
N-(4-chloro-2-methylphenyl)-2-(3,5-dimethylphenoxy)acetamide
CID 7784194
N-[4-chloro-2-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxyacetamide
CID 1247989
N-(2,5-dichlorophenyl)-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide
CID 1179092
2-(4-benzoylphenoxy)-N-(2,6-dimethylphenyl)acetamide
CID 7717850
2-[4-(4-chlorobenzoyl)phenoxy]-N-[4-(ethylsulfonylamino)-3-methylphenyl]acetamide
CID 55947056
N-[2-[[2-(4-chlorophenoxy)acetyl]amino]-4-methylphenyl]-2-phenoxyacetamide
CID 2954030
[4-[[3-methyl-4-[(2-phenoxyacetyl)amino]phenyl]carbamoyl]phenyl] acetate
CID 2233816

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide?
The IUPAC name of 2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide (CID 7717727) is 2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide?
The canonical SMILES for 2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide is Cc1cc(Cl)ccc1NC(=O)COc1ccc(C(=O)c2ccccc2)cc1.
What is the InChIKey of 2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide?
The InChIKey is TZXHYHIIFPJUFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18ClNO3/c1-15-13-18(23)9-12-20(15)24-21(25)14-27-19-10-7-17(8-11-19)22(26)16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,24,25).
What are the key properties of 2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide?
2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide has a molecular weight of 379.84 g/mol, XLogP of 4.90, 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-(4-chloro-2-methylphenyl)acetamide is sourced from PubChem (CID 7717727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).