N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide

C14H10BrClFNO — CID 43245530

IUPACN-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide
SMILESO=C(Nc1ccc(F)cc1Br)C(Cl)c1ccccc1
InChIInChI=1S/C14H10BrClFNO/c15-11-8-10(17)6-7-12(11)18-14(19)13(16)9-4-2-1-3-5-9/h1-8,13H,(H,18,19)
InChIKeyWXOACJPCJFVHRA-UHFFFAOYSA-N
MW342.60 g/mol
LogP4.51
Rot. Bonds3

About N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide

N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide (PubChem CID 43245530) has the molecular formula C14H10BrClFNO and a molecular weight of 342.60 g/mol. Its IUPAC name is N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide.

Molecular Properties

Compound NameN-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide
PubChem CID43245530
Molecular FormulaC14H10BrClFNO
Molecular Weight342.60 g/mol
Exact Mass340.96
IUPAC NameN-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide
SMILESO=C(Nc1ccc(F)cc1Br)C(Cl)c1ccccc1
InChIInChI=1S/C14H10BrClFNO/c15-11-8-10(17)6-7-12(11)18-14(19)13(16)9-4-2-1-3-5-9/h1-8,13H,(H,18,19)
InChIKeyWXOACJPCJFVHRA-UHFFFAOYSA-N
XLogP4.51
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.60
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(2-bromo-4-fluorophenyl)-2,2-diphenylacetamide
CID 52653705
2-chloro-N-(4-fluoro-2-methylphenyl)-2-phenylacetamide
CID 43212453
N-(4-bromo-2-chlorophenyl)-2-chloro-2-phenylacetamide
CID 43236641
(2-bromo-4-fluorophenyl)urea
CID 28939155
N-[(2-bromo-4-fluorophenyl)carbamoyl]-2-chloropropanamide
CID 43146418
2-amino-N-(2-chloro-4-fluorophenyl)-2-phenylacetamide
CID 43150560
N-(2-benzoyl-4-chlorophenyl)-2-chloro-2-(4-fluorophenyl)acetamide
CID 52916008
2-chloro-N-(2-methylsulfanylphenyl)-2-phenylacetamide
CID 43236531
N-(2-bromo-3-chlorophenyl)-2-chloro-2-phenylacetamide
CID 103478725
2-chloro-2-phenyl-N-(3,4,5-trifluorophenyl)acetamide
CID 62811265
3-amino-N-(2-bromo-4-fluorophenyl)-2-methylpropanamide
CID 62670318
(2S)-2-[(2-bromo-4-fluorophenyl)carbamoylamino]propanoic acid
CID 78967831

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide?
The IUPAC name of N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide (CID 43245530) is N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide.
What is the SMILES notation for N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide?
The canonical SMILES for N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide is O=C(Nc1ccc(F)cc1Br)C(Cl)c1ccccc1.
What is the InChIKey of N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide?
The InChIKey is WXOACJPCJFVHRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClFNO/c15-11-8-10(17)6-7-12(11)18-14(19)13(16)9-4-2-1-3-5-9/h1-8,13H,(H,18,19).
What are the key properties of N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide?
N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide has a molecular weight of 342.60 g/mol, XLogP of 4.51, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-fluorophenyl)-2-chloro-2-phenylacetamide is sourced from PubChem (CID 43245530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).