N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide

C14H10BrF2NO — CID 24689737

IUPACN-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide
SMILESCc1ccc(NC(=O)c2c(F)cccc2F)c(Br)c1
InChIInChI=1S/C14H10BrF2NO/c1-8-5-6-12(9(15)7-8)18-14(19)13-10(16)3-2-4-11(13)17/h2-7H,1H3,(H,18,19)
InChIKeyRDHAGDBXZIATHK-UHFFFAOYSA-N
MW326.14 g/mol
LogP4.29
Rot. Bonds2

About N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide

N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide (PubChem CID 24689737) has the molecular formula C14H10BrF2NO and a molecular weight of 326.14 g/mol. Its IUPAC name is N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide.

Molecular Properties

Compound NameN-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide
PubChem CID24689737
Molecular FormulaC14H10BrF2NO
Molecular Weight326.14 g/mol
Exact Mass324.99
IUPAC NameN-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide
SMILESCc1ccc(NC(=O)c2c(F)cccc2F)c(Br)c1
InChIInChI=1S/C14H10BrF2NO/c1-8-5-6-12(9(15)7-8)18-14(19)13-10(16)3-2-4-11(13)17/h2-7H,1H3,(H,18,19)
InChIKeyRDHAGDBXZIATHK-UHFFFAOYSA-N
XLogP4.29
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.14
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromo-N-(2,4-dimethylphenyl)-6-fluorobenzamide
CID 113250689
2-bromo-N-(2-chloro-4-methylphenyl)-6-fluorobenzamide
CID 115678082
2-amino-N-(2-bromo-4-methylphenyl)-3-fluorobenzamide
CID 62649187
N-(2,6-dibromo-4-methylphenyl)-2,6-difluorobenzamide
CID 4116047
N-(2-bromo-4-chlorophenyl)-2-fluoro-6-hydroxybenzamide
CID 107015030
N-(2-bromo-4-methylphenyl)-3-chloro-2-fluorobenzamide
CID 81004240
N-(2,4-difluorophenyl)-2,6-difluorobenzamide
CID 2796874
N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide
CID 107676274
N-(2-bromo-4-methylphenyl)-N'-(2-fluorophenyl)-2,2-dimethylpropanediamide
CID 108968743
2,3-difluoro-N-(2-fluoro-4-methylphenyl)benzamide
CID 62648850
N-(2-bromo-5-chloro-4-methylphenyl)-2-chloro-6-fluorobenzamide
CID 104724195
N-(2-bromo-5-methylphenyl)-2,6-dimethylbenzamide
CID 113341710

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide?
The IUPAC name of N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide (CID 24689737) is N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide.
What is the SMILES notation for N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide?
The canonical SMILES for N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide is Cc1ccc(NC(=O)c2c(F)cccc2F)c(Br)c1.
What is the InChIKey of N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide?
The InChIKey is RDHAGDBXZIATHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrF2NO/c1-8-5-6-12(9(15)7-8)18-14(19)13-10(16)3-2-4-11(13)17/h2-7H,1H3,(H,18,19).
What are the key properties of N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide?
N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide has a molecular weight of 326.14 g/mol, XLogP of 4.29, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-methylphenyl)-2,6-difluorobenzamide is sourced from PubChem (CID 24689737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).