2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide

C20H15BrClNO2 — CID 2234948

IUPAC2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide
SMILESO=C(COc1ccc(Br)cc1Cl)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C20H15BrClNO2/c21-15-10-11-19(17(22)12-15)25-13-20(24)23-18-9-5-4-8-16(18)14-6-2-1-3-7-14/h1-12H,13H2,(H,23,24)
InChIKeyAUMIMMYCMJFLJV-UHFFFAOYSA-N
MW416.70 g/mol
LogP5.79
Rot. Bonds5

About 2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide

2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide (PubChem CID 2234948) has the molecular formula C20H15BrClNO2 and a molecular weight of 416.70 g/mol. Its IUPAC name is 2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide
PubChem CID2234948
Molecular FormulaC20H15BrClNO2
Molecular Weight416.70 g/mol
Exact Mass415.00
IUPAC Name2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide
SMILESO=C(COc1ccc(Br)cc1Cl)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C20H15BrClNO2/c21-15-10-11-19(17(22)12-15)25-13-20(24)23-18-9-5-4-8-16(18)14-6-2-1-3-7-14/h1-12H,13H2,(H,23,24)
InChIKeyAUMIMMYCMJFLJV-UHFFFAOYSA-N
XLogP5.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.70
LogP ≤ 55.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-bromo-2-(hydroxymethyl)phenoxy]-N-(2-phenylphenyl)acetamide
CID 7701761
N-(2-phenylphenyl)-2-(2,4,5-trichlorophenoxy)acetamide
CID 7929959
2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide
CID 2198238
2-(4-bromo-2-chlorophenoxy)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)acetamide
CID 92546675
2-[[2-(4-bromo-2-chlorophenoxy)acetyl]amino]-N-(2-phenylethyl)benzamide
CID 4929767
2-(4-bromo-2,5-dimethylphenoxy)-N-(2-phenylphenyl)acetamide
CID 2233417
N-benzyl-2-(4-bromo-2-chlorophenoxy)acetamide
CID 2906661
N-[2-(azepane-1-carbonyl)phenyl]-2-(4-bromo-2-chlorophenoxy)acetamide
CID 4937939
3-[[2-(4-bromo-2-chlorophenoxy)acetyl]amino]-4-methylbenzoic acid
CID 45429183
2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide
CID 2230439
2-(3-chlorophenoxy)-N-(2-phenylphenyl)acetamide
CID 7818854
N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide
CID 55804154

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide?
The IUPAC name of 2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide (CID 2234948) is 2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide.
What is the SMILES notation for 2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide?
The canonical SMILES for 2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide is O=C(COc1ccc(Br)cc1Cl)Nc1ccccc1-c1ccccc1.
What is the InChIKey of 2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide?
The InChIKey is AUMIMMYCMJFLJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15BrClNO2/c21-15-10-11-19(17(22)12-15)25-13-20(24)23-18-9-5-4-8-16(18)14-6-2-1-3-7-14/h1-12H,13H2,(H,23,24).
What are the key properties of 2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide?
2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide has a molecular weight of 416.70 g/mol, XLogP of 5.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide is sourced from PubChem (CID 2234948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).