N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide

C13H8BrClFNO — CID 103753469

IUPACN-(2-bromo-5-fluorophenyl)-3-chlorobenzamide
SMILESO=C(Nc1cc(F)ccc1Br)c1cccc(Cl)c1
InChIInChI=1S/C13H8BrClFNO/c14-11-5-4-10(16)7-12(11)17-13(18)8-2-1-3-9(15)6-8/h1-7H,(H,17,18)
InChIKeyJPQYHLBUQZWKRI-UHFFFAOYSA-N
MW328.57 g/mol
LogP4.49
Rot. Bonds2

About N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide

N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide (PubChem CID 103753469) has the molecular formula C13H8BrClFNO and a molecular weight of 328.57 g/mol. Its IUPAC name is N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide.

Molecular Properties

Compound NameN-(2-bromo-5-fluorophenyl)-3-chlorobenzamide
PubChem CID103753469
Molecular FormulaC13H8BrClFNO
Molecular Weight328.57 g/mol
Exact Mass326.95
IUPAC NameN-(2-bromo-5-fluorophenyl)-3-chlorobenzamide
SMILESO=C(Nc1cc(F)ccc1Br)c1cccc(Cl)c1
InChIInChI=1S/C13H8BrClFNO/c14-11-5-4-10(16)7-12(11)17-13(18)8-2-1-3-9(15)6-8/h1-7H,(H,17,18)
InChIKeyJPQYHLBUQZWKRI-UHFFFAOYSA-N
XLogP4.49
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.57
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-bromo-5-fluorophenyl)-3-chloro-4-fluorobenzamide
CID 113264517
N-(2-bromo-5-fluorophenyl)-3-chloro-5-methylbenzamide
CID 103774481
N-(2-bromo-5-fluorophenyl)-3-[(E)-N'-hydroxycarbamimidoyl]benzamide
CID 107637415
N-(2-bromo-5-chlorophenyl)-3-iodobenzamide
CID 81270343
N-(2-bromo-5-fluorophenyl)-2-(3-chlorophenyl)acetamide
CID 103753346
N-(2-bromo-5-fluorophenyl)-4-chloro-3-methylbenzamide
CID 113256553
N-(2-bromo-5-fluorophenyl)-4-fluoro-3-methylbenzamide
CID 103753535
3-chloro-N-(4-fluoro-2-methoxyphenyl)benzamide
CID 32608919
N-(2-bromo-5-fluorophenyl)-4-chloropyridine-2-carboxamide
CID 103753577
N-(2-bromo-4-fluorophenyl)-3,5-dichlorobenzamide
CID 28938547
2-bromo-N-(2-bromo-5-fluorophenyl)pyridine-4-carboxamide
CID 103756062
2-amino-N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide
CID 107624293

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide?
The IUPAC name of N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide (CID 103753469) is N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide.
What is the SMILES notation for N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide?
The canonical SMILES for N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide is O=C(Nc1cc(F)ccc1Br)c1cccc(Cl)c1.
What is the InChIKey of N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide?
The InChIKey is JPQYHLBUQZWKRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrClFNO/c14-11-5-4-10(16)7-12(11)17-13(18)8-2-1-3-9(15)6-8/h1-7H,(H,17,18).
What are the key properties of N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide?
N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide has a molecular weight of 328.57 g/mol, XLogP of 4.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-5-fluorophenyl)-3-chlorobenzamide is sourced from PubChem (CID 103753469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).