2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide

C15H13BrFNO2 — CID 107284225

IUPAC2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide
SMILESCc1ccc(Br)cc1OCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C15H13BrFNO2/c1-10-2-3-11(16)8-14(10)20-9-15(19)18-13-6-4-12(17)5-7-13/h2-8H,9H2,1H3,(H,18,19)
InChIKeyCAFCRFBEPHBYOM-UHFFFAOYSA-N
MW338.18 g/mol
LogP3.91
Rot. Bonds4

About 2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide

2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide (PubChem CID 107284225) has the molecular formula C15H13BrFNO2 and a molecular weight of 338.18 g/mol. Its IUPAC name is 2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide
PubChem CID107284225
Molecular FormulaC15H13BrFNO2
Molecular Weight338.18 g/mol
Exact Mass337.01
IUPAC Name2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide
SMILESCc1ccc(Br)cc1OCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C15H13BrFNO2/c1-10-2-3-11(16)8-14(10)20-9-15(19)18-13-6-4-12(17)5-7-13/h2-8H,9H2,1H3,(H,18,19)
InChIKeyCAFCRFBEPHBYOM-UHFFFAOYSA-N
XLogP3.91
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.18
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-bromo-2-fluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 115918565
2-(4-bromo-2-cyanophenoxy)-N-(4-fluorophenyl)acetamide
CID 80611460
2-(2-bromo-4-methoxyphenoxy)-N-(4-fluorophenyl)acetamide
CID 104704640
2-[[2-(4-bromo-2-chlorophenoxy)acetyl]amino]-N-(4-fluorophenyl)acetamide
CID 16528162
2-(4-bromo-2-methylphenoxy)-N-[4-[[4-[[2-(4-bromo-2-methylphenoxy)acetyl]amino]phenyl]methyl]phenyl]acetamide
CID 5180817
N-(3-bromo-4-methylphenyl)-2-(4-fluorophenoxy)acetamide
CID 7818077
2-[2-bromo-4-[(3,4-dimethylanilino)methyl]phenoxy]-N-(4-fluorophenyl)acetamide
CID 3575641
N-(4-bromophenyl)-2-(4-fluoro-2-formylphenoxy)acetamide
CID 107697645
N-(3-bromophenyl)-2-(2,5-dimethylphenoxy)acetamide
CID 17252160
2-(2-amino-4-bromo-5-fluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 103482895
2-(2,5-dimethylphenoxy)-N-[(4-fluorophenyl)carbamothioyl]acetamide
CID 916660
2-(2,4-difluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 580280

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide (CID 107284225) is 2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide is Cc1ccc(Br)cc1OCC(=O)Nc1ccc(F)cc1.
What is the InChIKey of 2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide?
The InChIKey is CAFCRFBEPHBYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrFNO2/c1-10-2-3-11(16)8-14(10)20-9-15(19)18-13-6-4-12(17)5-7-13/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of 2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide?
2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide has a molecular weight of 338.18 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 107284225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).