3,5-dibromo-N-(3,5-difluorophenyl)benzamide

C13H7Br2F2NO — CID 107980035

IUPAC3,5-dibromo-N-(3,5-difluorophenyl)benzamide
SMILESO=C(Nc1cc(F)cc(F)c1)c1cc(Br)cc(Br)c1
InChIInChI=1S/C13H7Br2F2NO/c14-8-1-7(2-9(15)3-8)13(19)18-12-5-10(16)4-11(17)6-12/h1-6H,(H,18,19)
InChIKeyRJIDBBOVONCSOA-UHFFFAOYSA-N
MW391.01 g/mol
LogP4.74
Rot. Bonds2

About 3,5-dibromo-N-(3,5-difluorophenyl)benzamide

3,5-dibromo-N-(3,5-difluorophenyl)benzamide (PubChem CID 107980035) has the molecular formula C13H7Br2F2NO and a molecular weight of 391.01 g/mol. Its IUPAC name is 3,5-dibromo-N-(3,5-difluorophenyl)benzamide.

Molecular Properties

Compound Name3,5-dibromo-N-(3,5-difluorophenyl)benzamide
PubChem CID107980035
Molecular FormulaC13H7Br2F2NO
Molecular Weight391.01 g/mol
Exact Mass388.89
IUPAC Name3,5-dibromo-N-(3,5-difluorophenyl)benzamide
SMILESO=C(Nc1cc(F)cc(F)c1)c1cc(Br)cc(Br)c1
InChIInChI=1S/C13H7Br2F2NO/c14-8-1-7(2-9(15)3-8)13(19)18-12-5-10(16)4-11(17)6-12/h1-6H,(H,18,19)
InChIKeyRJIDBBOVONCSOA-UHFFFAOYSA-N
XLogP4.74
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.01
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-bromo-N-(3-fluoro-5-methylphenyl)-5-methylbenzamide
CID 113460801
N-(3,5-dibromo-4-hydroxyphenyl)-3,5-difluorobenzamide
CID 25224306
3-bromo-N-(3-chloro-5-fluorophenyl)-5-methylbenzamide
CID 107366667
3-bromo-5-[(3,5-dibromobenzoyl)amino]benzoic acid
CID 107971617
3,5-diamino-N-(3,5-difluorophenyl)benzamide
CID 61091904
N-(3-bromophenyl)-3,5-difluorobenzamide
CID 3660841
5-bromo-N-(3,5-difluorophenyl)thiophene-3-carboxamide
CID 39642819
3-bromo-5-fluoro-N-(3,4,5-trimethoxyphenyl)benzamide
CID 110426879
3,5-dibromo-N-(4-bromo-2,6-difluorophenyl)benzamide
CID 107972354
3-bromo-N-(3-bromo-4-methylphenyl)-5-fluorobenzamide
CID 63529818
3-bromo-4-chloro-N-(3,5-difluorophenyl)benzamide
CID 114025876
3,5-dibromo-N-(4-chloro-3-fluorophenyl)benzamide
CID 107980248

Frequently Asked Questions

What is the IUPAC name of 3,5-dibromo-N-(3,5-difluorophenyl)benzamide?
The IUPAC name of 3,5-dibromo-N-(3,5-difluorophenyl)benzamide (CID 107980035) is 3,5-dibromo-N-(3,5-difluorophenyl)benzamide.
What is the SMILES notation for 3,5-dibromo-N-(3,5-difluorophenyl)benzamide?
The canonical SMILES for 3,5-dibromo-N-(3,5-difluorophenyl)benzamide is O=C(Nc1cc(F)cc(F)c1)c1cc(Br)cc(Br)c1.
What is the InChIKey of 3,5-dibromo-N-(3,5-difluorophenyl)benzamide?
The InChIKey is RJIDBBOVONCSOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Br2F2NO/c14-8-1-7(2-9(15)3-8)13(19)18-12-5-10(16)4-11(17)6-12/h1-6H,(H,18,19).
What are the key properties of 3,5-dibromo-N-(3,5-difluorophenyl)benzamide?
3,5-dibromo-N-(3,5-difluorophenyl)benzamide has a molecular weight of 391.01 g/mol, XLogP of 4.74, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromo-N-(3,5-difluorophenyl)benzamide is sourced from PubChem (CID 107980035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).