2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide

C16H15BrFNO2 — CID 26036611

IUPAC2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)COc1ccc(Br)cc1F
InChIInChI=1S/C16H15BrFNO2/c1-2-11-5-3-4-6-14(11)19-16(20)10-21-15-8-7-12(17)9-13(15)18/h3-9H,2,10H2,1H3,(H,19,20)
InChIKeyISQUIKVQQLXEIN-UHFFFAOYSA-N
MW352.20 g/mol
LogP4.17
Rot. Bonds5

About 2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide

2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide (PubChem CID 26036611) has the molecular formula C16H15BrFNO2 and a molecular weight of 352.20 g/mol. Its IUPAC name is 2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide
PubChem CID26036611
Molecular FormulaC16H15BrFNO2
Molecular Weight352.20 g/mol
Exact Mass351.03
IUPAC Name2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide
SMILESCCc1ccccc1NC(=O)COc1ccc(Br)cc1F
InChIInChI=1S/C16H15BrFNO2/c1-2-11-5-3-4-6-14(11)19-16(20)10-21-15-8-7-12(17)9-13(15)18/h3-9H,2,10H2,1H3,(H,19,20)
InChIKeyISQUIKVQQLXEIN-UHFFFAOYSA-N
XLogP4.17
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.20
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]benzamide
CID 7500273
2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide
CID 26894979
2-(4-bromo-2-fluorophenoxy)-N-(2-chloro-3-pyridinyl)acetamide
CID 2522815
2-(4-bromo-2-fluorophenoxy)-N-(2,4-difluorophenyl)acetamide
CID 2523027
2-(4-bromo-2-fluorophenoxy)-N-(2-bromo-4-methylphenyl)acetamide
CID 26524063
2-(4-bromo-2-fluorophenoxy)-N-[4-(dimethylamino)-2-methylphenyl]acetamide
CID 55709588
N-benzyl-2-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]benzamide
CID 17442660
2-(4-bromo-2-propan-2-ylphenoxy)-N-(2-fluorophenyl)acetamide
CID 17188911
N-(5-amino-2-methylphenyl)-2-(4-bromo-2-fluorophenoxy)acetamide
CID 28971329
2-[[2-(2-bromo-4-fluorophenoxy)acetyl]amino]-N-(2-ethylphenyl)acetamide
CID 34648970
2-(2-aminophenoxy)-N-(4-bromo-2-ethylphenyl)acetamide
CID 81289571
2-(2-acetamidophenoxy)-N-(2-ethylphenyl)acetamide
CID 7867330

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide?
The IUPAC name of 2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide (CID 26036611) is 2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide.
What is the SMILES notation for 2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide?
The canonical SMILES for 2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide is CCc1ccccc1NC(=O)COc1ccc(Br)cc1F.
What is the InChIKey of 2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide?
The InChIKey is ISQUIKVQQLXEIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15BrFNO2/c1-2-11-5-3-4-6-14(11)19-16(20)10-21-15-8-7-12(17)9-13(15)18/h3-9H,2,10H2,1H3,(H,19,20).
What are the key properties of 2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide?
2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide has a molecular weight of 352.20 g/mol, XLogP of 4.17, 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-fluorophenoxy)-N-(2-ethylphenyl)acetamide is sourced from PubChem (CID 26036611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).