N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide

C27H20ClNO3 — CID 19169901

IUPACN-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(Cl)cc1C(=O)c1ccccc1
InChIInChI=1S/C27H20ClNO3/c28-22-13-16-25(24(17-22)27(31)21-9-5-2-6-10-21)29-26(30)18-32-23-14-11-20(12-15-23)19-7-3-1-4-8-19/h1-17H,18H2,(H,29,30)
InChIKeyLIDGCTSLXSPRCW-UHFFFAOYSA-N
MW441.91 g/mol
LogP6.26
Rot. Bonds7

About N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide

N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide (PubChem CID 19169901) has the molecular formula C27H20ClNO3 and a molecular weight of 441.91 g/mol. Its IUPAC name is N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide
PubChem CID19169901
Molecular FormulaC27H20ClNO3
Molecular Weight441.91 g/mol
Exact Mass441.11
IUPAC NameN-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(Cl)cc1C(=O)c1ccccc1
InChIInChI=1S/C27H20ClNO3/c28-22-13-16-25(24(17-22)27(31)21-9-5-2-6-10-21)29-26(30)18-32-23-14-11-20(12-15-23)19-7-3-1-4-8-19/h1-17H,18H2,(H,29,30)
InChIKeyLIDGCTSLXSPRCW-UHFFFAOYSA-N
XLogP6.26
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500441.91
LogP ≤ 56.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-benzoyl-4-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 3544695
5-chloro-2-[[2-(3-phenylphenoxy)acetyl]amino]benzoic acid
CID 66680457
2-(4-benzoylphenoxy)-N-(4-chloro-2-methylphenyl)acetamide
CID 7717727
N-(2-benzoyl-4-chlorophenyl)-4-phenoxybutanamide
CID 19172248
N-(2-benzoyl-4-chlorophenyl)-2-iodoacetamide
CID 12500538
N-(2-benzoyl-4-chlorophenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 1019246
[2-(2-benzoyl-4-chloroanilino)-2-oxoethyl] 2-methylpropanoate
CID 7782592
N-(5-chloro-2-methoxyphenyl)-2-(4-phenylphenoxy)acetamide
CID 1193872
N-[4-chloro-2-[(R)-hydroxy(phenyl)methyl]phenyl]-2-(4-phenylphenoxy)acetamide
CID 95733672
N-[4-chloro-2-[(2-phenoxyacetyl)amino]phenyl]-2-phenoxyacetamide
CID 1247989
N-(2-benzoyl-4-chlorophenyl)-2-(2-nitrophenoxy)acetamide
CID 1182886
N-(2-benzoyl-4-chlorophenyl)-2-[4-[(4-fluorophenyl)methyl-methylsulfonylamino]phenoxy]acetamide
CID 43888584

Frequently Asked Questions

What is the IUPAC name of N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide?
The IUPAC name of N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide (CID 19169901) is N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide.
What is the SMILES notation for N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide?
The canonical SMILES for N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide is O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(Cl)cc1C(=O)c1ccccc1.
What is the InChIKey of N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide?
The InChIKey is LIDGCTSLXSPRCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20ClNO3/c28-22-13-16-25(24(17-22)27(31)21-9-5-2-6-10-21)29-26(30)18-32-23-14-11-20(12-15-23)19-7-3-1-4-8-19/h1-17H,18H2,(H,29,30).
What are the key properties of N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide?
N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide has a molecular weight of 441.91 g/mol, XLogP of 6.26, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzoyl-4-chlorophenyl)-2-(4-phenylphenoxy)acetamide is sourced from PubChem (CID 19169901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).