2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide

C15H11BrF3NO3 — CID 26894979

IUPAC2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide
SMILESO=C(COc1ccc(Br)cc1F)Nc1ccccc1OC(F)F
InChIInChI=1S/C15H11BrF3NO3/c16-9-5-6-12(10(17)7-9)22-8-14(21)20-11-3-1-2-4-13(11)23-15(18)19/h1-7,15H,8H2,(H,20,21)
InChIKeyWXVNYUGEYOJOHB-UHFFFAOYSA-N
MW390.16 g/mol
LogP4.21
Rot. Bonds6

About 2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide

2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide (PubChem CID 26894979) has the molecular formula C15H11BrF3NO3 and a molecular weight of 390.16 g/mol. Its IUPAC name is 2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide
PubChem CID26894979
Molecular FormulaC15H11BrF3NO3
Molecular Weight390.16 g/mol
Exact Mass388.99
IUPAC Name2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide
SMILESO=C(COc1ccc(Br)cc1F)Nc1ccccc1OC(F)F
InChIInChI=1S/C15H11BrF3NO3/c16-9-5-6-12(10(17)7-9)22-8-14(21)20-11-3-1-2-4-13(11)23-15(18)19/h1-7,15H,8H2,(H,20,21)
InChIKeyWXVNYUGEYOJOHB-UHFFFAOYSA-N
XLogP4.21
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.16
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]benzamide
CID 7500273
2-(4-bromo-2-fluorophenoxy)-N-(2-ethylphenyl)acetamide
CID 26036611
2-(4-bromo-2-fluorophenoxy)-N-(2,4-difluorophenyl)acetamide
CID 2523027
methyl 3-bromo-4-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzoate
CID 36941226
N-[2-(difluoromethoxy)phenyl]-2-(2-ethoxyphenoxy)acetamide
CID 7941491
2-(4-bromo-2-fluorophenoxy)-N-(2-chloro-3-pyridinyl)acetamide
CID 2522815
[2-[2-(difluoromethoxy)anilino]-2-oxoethyl] 5-bromo-2-chlorobenzoate
CID 2400404
2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide
CID 7278808
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
2-(4-bromo-2-fluorophenoxy)-N-(2-bromo-4-methylphenyl)acetamide
CID 26524063
2-(2,4-difluorophenoxy)-N-(2-hydroxyphenyl)acetamide
CID 31984086

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide?
The IUPAC name of 2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide (CID 26894979) is 2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide?
The canonical SMILES for 2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide is O=C(COc1ccc(Br)cc1F)Nc1ccccc1OC(F)F.
What is the InChIKey of 2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide?
The InChIKey is WXVNYUGEYOJOHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrF3NO3/c16-9-5-6-12(10(17)7-9)22-8-14(21)20-11-3-1-2-4-13(11)23-15(18)19/h1-7,15H,8H2,(H,20,21).
What are the key properties of 2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide?
2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide has a molecular weight of 390.16 g/mol, XLogP of 4.21, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-fluorophenoxy)-N-[2-(difluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 26894979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).