N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide

C9H8Br2FNO2 — CID 86654326

IUPACN-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide
SMILESCOc1c(Br)cc(F)c(NC(C)=O)c1Br
InChIInChI=1S/C9H8Br2FNO2/c1-4(14)13-8-6(12)3-5(10)9(15-2)7(8)11/h3H,1-2H3,(H,13,14)
InChIKeyLMPGLQAAIMTQHG-UHFFFAOYSA-N
MW340.97 g/mol
LogP3.32
Rot. Bonds2

About N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide

N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide (PubChem CID 86654326) has the molecular formula C9H8Br2FNO2 and a molecular weight of 340.97 g/mol. Its IUPAC name is N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide
PubChem CID86654326
Molecular FormulaC9H8Br2FNO2
Molecular Weight340.97 g/mol
Exact Mass338.89
IUPAC NameN-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide
SMILESCOc1c(Br)cc(F)c(NC(C)=O)c1Br
InChIInChI=1S/C9H8Br2FNO2/c1-4(14)13-8-6(12)3-5(10)9(15-2)7(8)11/h3H,1-2H3,(H,13,14)
InChIKeyLMPGLQAAIMTQHG-UHFFFAOYSA-N
XLogP3.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.97
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-bromo-6-fluoro-2-hydroxy-3-methoxyphenyl)propan-2-one
CID 84714597
methyl 6-bromo-2,4-difluoro-3-methoxybenzoate
CID 118189517
N-(2,6-difluoro-3,5-dimethoxyphenyl)acetamide
CID 150969889
1-(5-bromo-3-fluoro-2,4-dimethoxyphenyl)ethanone
CID 84714598
1-(2-bromo-4-fluoro-3-methoxyphenyl)ethanone
CID 171005543
N-(2,3,4,6-tetrafluorophenyl)acetamide
CID 130006271
N-(2-bromo-6-fluorophenyl)acetamide
CID 59145529
N-[4-bromo-2-fluoro-6-(trifluoromethyl)phenyl]acetamide
CID 19810893
N-(3-bromo-4-methoxy-2,6-dimethylphenyl)acetamide
CID 155615406
methyl 2-(2-bromo-6-fluoro-4-hydroxy-3-methoxyphenyl)-2-hydroxyacetate
CID 117493779
ethyl 4-(N-acetyl-2,4-dibromo-6-fluoro-3-methoxyanilino)but-2-enoate
CID 123526182
1-[3-bromo-5-(difluoromethyl)-2-methoxyphenyl]ethanone
CID 131569733

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide?
The IUPAC name of N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide (CID 86654326) is N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide.
What is the SMILES notation for N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide?
The canonical SMILES for N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide is COc1c(Br)cc(F)c(NC(C)=O)c1Br.
What is the InChIKey of N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide?
The InChIKey is LMPGLQAAIMTQHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8Br2FNO2/c1-4(14)13-8-6(12)3-5(10)9(15-2)7(8)11/h3H,1-2H3,(H,13,14).
What are the key properties of N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide?
N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide has a molecular weight of 340.97 g/mol, XLogP of 3.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide is sourced from PubChem (CID 86654326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).