N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide

C14H9BrF3NO — CID 103842716

IUPACN-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide
SMILESO=C(Cc1cccc(F)c1)Nc1cc(F)c(Br)cc1F
InChIInChI=1S/C14H9BrF3NO/c15-10-6-12(18)13(7-11(10)17)19-14(20)5-8-2-1-3-9(16)4-8/h1-4,6-7H,5H2,(H,19,20)
InChIKeyOVIGLVIZGKAGHU-UHFFFAOYSA-N
MW344.13 g/mol
LogP4.05
Rot. Bonds3

About N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide

N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide (PubChem CID 103842716) has the molecular formula C14H9BrF3NO and a molecular weight of 344.13 g/mol. Its IUPAC name is N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide
PubChem CID103842716
Molecular FormulaC14H9BrF3NO
Molecular Weight344.13 g/mol
Exact Mass342.98
IUPAC NameN-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide
SMILESO=C(Cc1cccc(F)c1)Nc1cc(F)c(Br)cc1F
InChIInChI=1S/C14H9BrF3NO/c15-10-6-12(18)13(7-11(10)17)19-14(20)5-8-2-1-3-9(16)4-8/h1-4,6-7H,5H2,(H,19,20)
InChIKeyOVIGLVIZGKAGHU-UHFFFAOYSA-N
XLogP4.05
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.13
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

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Related Compounds

N-(5-bromo-4-fluoro-2-methylphenyl)-2-(3-fluorophenyl)acetamide
CID 103274575
N-(4-bromo-2,5-difluorophenyl)-2-(2,4-difluorophenyl)acetamide
CID 103842501
N-(4-bromo-2,5-difluorophenyl)-2-(2-fluorophenyl)acetamide
CID 103842634
N-(5-bromo-2-methylphenyl)-2-(3-fluorophenyl)acetamide
CID 43806426
2-bromo-N-(4-bromo-2,5-difluorophenyl)acetamide
CID 107610790
2-(2-bromophenyl)-N-(2,4-difluorophenyl)acetamide
CID 113098832
2-(3-fluorophenyl)-N-(3-hydroxy-2-methylphenyl)acetamide
CID 64793447
N-(2-bromo-5-fluorophenyl)-2-(3-chlorophenyl)acetamide
CID 103753346
N-(2-amino-4-methylphenyl)-2-(3-fluorophenyl)acetamide
CID 43259058
N-(2-bromo-4-fluorophenyl)-2-(3-chlorophenyl)acetamide
CID 62503410
N-(5-amino-2,4-dimethylphenyl)-2-(3-fluorophenyl)acetamide
CID 104757005
2-(3-bromophenyl)-N-[2-(2,4-difluoroanilino)-2-oxoethyl]acetamide
CID 113000854

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide?
The IUPAC name of N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide (CID 103842716) is N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide.
What is the SMILES notation for N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide?
The canonical SMILES for N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide is O=C(Cc1cccc(F)c1)Nc1cc(F)c(Br)cc1F.
What is the InChIKey of N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide?
The InChIKey is OVIGLVIZGKAGHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9BrF3NO/c15-10-6-12(18)13(7-11(10)17)19-14(20)5-8-2-1-3-9(16)4-8/h1-4,6-7H,5H2,(H,19,20).
What are the key properties of N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide?
N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide has a molecular weight of 344.13 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2,5-difluorophenyl)-2-(3-fluorophenyl)acetamide is sourced from PubChem (CID 103842716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).