N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide

C15H11BrFNO2 — CID 24711733

IUPACN-(2-acetylphenyl)-5-bromo-2-fluorobenzamide
SMILESCC(=O)c1ccccc1NC(=O)c1cc(Br)ccc1F
InChIInChI=1S/C15H11BrFNO2/c1-9(19)11-4-2-3-5-14(11)18-15(20)12-8-10(16)6-7-13(12)17/h2-8H,1H3,(H,18,20)
InChIKeyLXVPWXZIPQXELL-UHFFFAOYSA-N
MW336.16 g/mol
LogP4.04
Rot. Bonds3

About N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide

N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide (PubChem CID 24711733) has the molecular formula C15H11BrFNO2 and a molecular weight of 336.16 g/mol. Its IUPAC name is N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide.

Molecular Properties

Compound NameN-(2-acetylphenyl)-5-bromo-2-fluorobenzamide
PubChem CID24711733
Molecular FormulaC15H11BrFNO2
Molecular Weight336.16 g/mol
Exact Mass335.00
IUPAC NameN-(2-acetylphenyl)-5-bromo-2-fluorobenzamide
SMILESCC(=O)c1ccccc1NC(=O)c1cc(Br)ccc1F
InChIInChI=1S/C15H11BrFNO2/c1-9(19)11-4-2-3-5-14(11)18-15(20)12-8-10(16)6-7-13(12)17/h2-8H,1H3,(H,18,20)
InChIKeyLXVPWXZIPQXELL-UHFFFAOYSA-N
XLogP4.04
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.16
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-2-fluoro-N-(2-fluorophenyl)benzamide
CID 24699182
5-bromo-N-(2-ethylsulfanylphenyl)-2-fluorobenzamide
CID 47267896
5-bromo-2-fluoro-N-(2-fluoro-4-hydroxyphenyl)benzamide
CID 64793128
N-(2-acetylphenyl)-4-bromo-3-fluorobenzamide
CID 47421879
5-bromo-2-fluoro-N-(4-hydroxyphenyl)benzamide
CID 28739625
N-(2-acetylphenyl)-2,5-dichlorobenzamide
CID 26067712
5-bromo-2-fluoro-N-[4-[(2-fluorobenzoyl)amino]-2-(trifluoromethyl)phenyl]benzamide
CID 55765621
5-bromo-2-fluoro-N-(2,4,5-trichlorophenyl)benzamide
CID 28547728
5-bromo-N-(2-chloro-4,5-dimethoxyphenyl)-2-fluorobenzamide
CID 30804369
N-(2-acetylphenyl)-5-bromo-2-(tetrazol-1-yl)benzamide
CID 29135709
5-bromo-N-(2-carbamothioyl-3-methylphenyl)-2-fluorobenzamide
CID 107805652
N-(2-acetylphenyl)-2,5-dibromothiophene-3-carboxamide
CID 113237224

Frequently Asked Questions

What is the IUPAC name of N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide?
The IUPAC name of N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide (CID 24711733) is N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide.
What is the SMILES notation for N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide?
The canonical SMILES for N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide is CC(=O)c1ccccc1NC(=O)c1cc(Br)ccc1F.
What is the InChIKey of N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide?
The InChIKey is LXVPWXZIPQXELL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrFNO2/c1-9(19)11-4-2-3-5-14(11)18-15(20)12-8-10(16)6-7-13(12)17/h2-8H,1H3,(H,18,20).
What are the key properties of N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide?
N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide has a molecular weight of 336.16 g/mol, XLogP of 4.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-5-bromo-2-fluorobenzamide is sourced from PubChem (CID 24711733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).