N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide

C13H8BrF2NO — CID 103741284

IUPACN-(2-bromo-6-fluorophenyl)-4-fluorobenzamide
SMILESO=C(Nc1c(F)cccc1Br)c1ccc(F)cc1
InChIInChI=1S/C13H8BrF2NO/c14-10-2-1-3-11(16)12(10)17-13(18)8-4-6-9(15)7-5-8/h1-7H,(H,17,18)
InChIKeyGMIONZKMNHWNGP-UHFFFAOYSA-N
MW312.11 g/mol
LogP3.98
Rot. Bonds2

About N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide

N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide (PubChem CID 103741284) has the molecular formula C13H8BrF2NO and a molecular weight of 312.11 g/mol. Its IUPAC name is N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide.

Molecular Properties

Compound NameN-(2-bromo-6-fluorophenyl)-4-fluorobenzamide
PubChem CID103741284
Molecular FormulaC13H8BrF2NO
Molecular Weight312.11 g/mol
Exact Mass310.98
IUPAC NameN-(2-bromo-6-fluorophenyl)-4-fluorobenzamide
SMILESO=C(Nc1c(F)cccc1Br)c1ccc(F)cc1
InChIInChI=1S/C13H8BrF2NO/c14-10-2-1-3-11(16)12(10)17-13(18)8-4-6-9(15)7-5-8/h1-7H,(H,17,18)
InChIKeyGMIONZKMNHWNGP-UHFFFAOYSA-N
XLogP3.98
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.11
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-bromo-6-fluorophenyl)-4-(propylamino)benzamide
CID 107603351
3,5-diamino-N-(2-bromo-6-fluorophenyl)benzamide
CID 107596194
N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide
CID 103741269
3-amino-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide
CID 107596191
N-(2-bromo-6-fluorophenyl)-3-chloro-4-hydroxybenzamide
CID 107600810
2-amino-N-(2-bromo-6-fluorophenyl)-5-fluorobenzamide
CID 107596162
N-(2-bromo-6-fluorophenyl)-3-chloro-4-iodobenzamide
CID 107600677
N-(2-bromo-6-fluorophenyl)-3H-benzimidazole-5-carboxamide
CID 107602612
N-(2-bromo-6-fluorophenyl)acetamide
CID 59145529
3-bromo-N-(2-bromo-6-fluorophenyl)-5-methylbenzamide
CID 113461585
N-(2-bromo-6-fluorophenyl)-2,3-dihydro-1H-indole-6-carboxamide
CID 107600018
3-amino-N-(2-bromo-6-fluorophenyl)-4-(dimethylamino)benzamide
CID 107596229

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide?
The IUPAC name of N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide (CID 103741284) is N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide.
What is the SMILES notation for N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide?
The canonical SMILES for N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide is O=C(Nc1c(F)cccc1Br)c1ccc(F)cc1.
What is the InChIKey of N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide?
The InChIKey is GMIONZKMNHWNGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrF2NO/c14-10-2-1-3-11(16)12(10)17-13(18)8-4-6-9(15)7-5-8/h1-7H,(H,17,18).
What are the key properties of N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide?
N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide has a molecular weight of 312.11 g/mol, XLogP of 3.98, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide is sourced from PubChem (CID 103741284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).