N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide

C14H9BrF3NO2 — CID 65436031

IUPACN-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide
SMILESO=C(Nc1ccc(Br)c(F)c1)c1ccccc1OC(F)F
InChIInChI=1S/C14H9BrF3NO2/c15-10-6-5-8(7-11(10)16)19-13(20)9-3-1-2-4-12(9)21-14(17)18/h1-7,14H,(H,19,20)
InChIKeyVVFXVJTWICQNDU-UHFFFAOYSA-N
MW360.13 g/mol
LogP4.44
Rot. Bonds4

About N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide

N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide (PubChem CID 65436031) has the molecular formula C14H9BrF3NO2 and a molecular weight of 360.13 g/mol. Its IUPAC name is N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide.

Molecular Properties

Compound NameN-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide
PubChem CID65436031
Molecular FormulaC14H9BrF3NO2
Molecular Weight360.13 g/mol
Exact Mass358.98
IUPAC NameN-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide
SMILESO=C(Nc1ccc(Br)c(F)c1)c1ccccc1OC(F)F
InChIInChI=1S/C14H9BrF3NO2/c15-10-6-5-8(7-11(10)16)19-13(20)9-3-1-2-4-12(9)21-14(17)18/h1-7,14H,(H,19,20)
InChIKeyVVFXVJTWICQNDU-UHFFFAOYSA-N
XLogP4.44
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.13
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromo-3-fluorophenyl)-2-fluorobenzamide
CID 65436517
N-(2-bromo-5-chlorophenyl)-2-(difluoromethoxy)benzamide
CID 81260760
N-(4-bromo-2-fluorophenyl)-2-(difluoromethoxy)benzamide
CID 26362983
5-bromo-2-chloro-N-[4-(difluoromethoxy)-3-fluorophenyl]-4-fluorobenzamide
CID 171463789
2-(difluoromethoxy)-N-(3-methylsulfanylphenyl)benzamide
CID 26086758
methyl 3-[[2-(difluoromethoxy)benzoyl]amino]benzoate
CID 17414154
3-bromo-N-(4-bromo-3-fluorophenyl)-2-chlorobenzamide
CID 113402951
2-(difluoromethoxy)-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 39977055
2-(difluoromethoxy)-N-(2-methyl-1H-indol-5-yl)benzamide
CID 46481565
N-(4-bromo-3-fluorophenyl)-3-chloro-2-fluorobenzamide
CID 81002084
2-(difluoromethoxy)-N-[4-(dimethylcarbamoyl)phenyl]benzamide
CID 26904916
2-(difluoromethoxy)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)benzamide
CID 38468167

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide?
The IUPAC name of N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide (CID 65436031) is N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide.
What is the SMILES notation for N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide?
The canonical SMILES for N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide is O=C(Nc1ccc(Br)c(F)c1)c1ccccc1OC(F)F.
What is the InChIKey of N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide?
The InChIKey is VVFXVJTWICQNDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9BrF3NO2/c15-10-6-5-8(7-11(10)16)19-13(20)9-3-1-2-4-12(9)21-14(17)18/h1-7,14H,(H,19,20).
What are the key properties of N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide?
N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide has a molecular weight of 360.13 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-fluorophenyl)-2-(difluoromethoxy)benzamide is sourced from PubChem (CID 65436031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).