N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide

C15H13BrF2N2O — CID 62510189

IUPACN-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide
SMILESCNc1ccc(C)cc1C(=O)Nc1c(F)cc(F)cc1Br
InChIInChI=1S/C15H13BrF2N2O/c1-8-3-4-13(19-2)10(5-8)15(21)20-14-11(16)6-9(17)7-12(14)18/h3-7,19H,1-2H3,(H,20,21)
InChIKeyDSIIILZTJBBBIC-UHFFFAOYSA-N
MW355.18 g/mol
LogP4.33
Rot. Bonds3

About N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide

N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide (PubChem CID 62510189) has the molecular formula C15H13BrF2N2O and a molecular weight of 355.18 g/mol. Its IUPAC name is N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide
PubChem CID62510189
Molecular FormulaC15H13BrF2N2O
Molecular Weight355.18 g/mol
Exact Mass354.02
IUPAC NameN-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide
SMILESCNc1ccc(C)cc1C(=O)Nc1c(F)cc(F)cc1Br
InChIInChI=1S/C15H13BrF2N2O/c1-8-3-4-13(19-2)10(5-8)15(21)20-14-11(16)6-9(17)7-12(14)18/h3-7,19H,1-2H3,(H,20,21)
InChIKeyDSIIILZTJBBBIC-UHFFFAOYSA-N
XLogP4.33
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.18
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-4-fluorophenyl)-5-methyl-2-(methylamino)benzamide
CID 62509154
N-(3-fluoro-5-methylphenyl)-5-methyl-2-(methylamino)benzamide
CID 79046553
N-(4-bromo-2,6-dimethylphenyl)-5-methyl-2-(methylamino)benzamide
CID 62510325
2-bromo-N-(2-chloro-4,6-difluorophenyl)-5-methylbenzamide
CID 82889504
5-methyl-2-(methylamino)-N-(2,4,5-trifluorophenyl)benzamide
CID 62809031
N-(4-bromo-2,6-dichlorophenyl)-5-methyl-2-(methylamino)benzamide
CID 62511408
N-(2-bromo-4,6-difluorophenyl)-2-hydroxy-3-methylbenzamide
CID 43244596
2-fluoro-5-methyl-N-(2,4,6-tribromophenyl)benzamide
CID 62509199
N-(2-chloro-4-fluorophenyl)-5-methyl-2-(methylamino)benzamide
CID 62511235
N-(2-bromo-4,6-difluorophenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 62167720
N-(2,6-dichlorophenyl)-5-methyl-2-(methylamino)benzamide
CID 65499464
N-(4-bromo-2-methylphenyl)-5-methyl-2-(methylamino)benzamide
CID 62509130

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide?
The IUPAC name of N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide (CID 62510189) is N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide.
What is the SMILES notation for N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide?
The canonical SMILES for N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide is CNc1ccc(C)cc1C(=O)Nc1c(F)cc(F)cc1Br.
What is the InChIKey of N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide?
The InChIKey is DSIIILZTJBBBIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrF2N2O/c1-8-3-4-13(19-2)10(5-8)15(21)20-14-11(16)6-9(17)7-12(14)18/h3-7,19H,1-2H3,(H,20,21).
What are the key properties of N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide?
N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide has a molecular weight of 355.18 g/mol, XLogP of 4.33, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4,6-difluorophenyl)-5-methyl-2-(methylamino)benzamide is sourced from PubChem (CID 62510189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).