N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide

C14H12BrFN2O — CID 107601184

IUPACN-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide
SMILESCNc1ccccc1C(=O)Nc1c(F)cccc1Br
InChIInChI=1S/C14H12BrFN2O/c1-17-12-8-3-2-5-9(12)14(19)18-13-10(15)6-4-7-11(13)16/h2-8,17H,1H3,(H,18,19)
InChIKeyJKMAXYMLOYCMRI-UHFFFAOYSA-N
MW323.17 g/mol
LogP3.88
Rot. Bonds3

About N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide

N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide (PubChem CID 107601184) has the molecular formula C14H12BrFN2O and a molecular weight of 323.17 g/mol. Its IUPAC name is N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide
PubChem CID107601184
Molecular FormulaC14H12BrFN2O
Molecular Weight323.17 g/mol
Exact Mass322.01
IUPAC NameN-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide
SMILESCNc1ccccc1C(=O)Nc1c(F)cccc1Br
InChIInChI=1S/C14H12BrFN2O/c1-17-12-8-3-2-5-9(12)14(19)18-13-10(15)6-4-7-11(13)16/h2-8,17H,1H3,(H,18,19)
InChIKeyJKMAXYMLOYCMRI-UHFFFAOYSA-N
XLogP3.88
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.17
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide
CID 103741269
N-(2,6-dibromo-4-methylphenyl)-2-(methylamino)benzamide
CID 61377648
3-amino-2-bromo-N-(2-bromo-6-fluorophenyl)benzamide
CID 107596264
N-(2-bromo-6-fluorophenyl)acetamide
CID 59145529
N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide
CID 103741284
N-(2-bromo-6-fluorophenyl)-1H-indole-3-carboxamide
CID 107602604
N-(2-bromo-6-fluorophenyl)-2-fluoro-4-hydroxybenzamide
CID 107676888
N-(3-bromo-2-methylphenyl)-2-fluorobenzamide
CID 66606524
N-(2-bromo-6-fluorophenyl)-2,3-difluoropyridine-4-carboxamide
CID 107470490
N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide
CID 107603315
2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide
CID 103765558
2-amino-N-(2-bromo-6-fluorophenyl)-5-fluorobenzamide
CID 107596162

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide?
The IUPAC name of N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide (CID 107601184) is N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide.
What is the SMILES notation for N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide?
The canonical SMILES for N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide is CNc1ccccc1C(=O)Nc1c(F)cccc1Br.
What is the InChIKey of N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide?
The InChIKey is JKMAXYMLOYCMRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrFN2O/c1-17-12-8-3-2-5-9(12)14(19)18-13-10(15)6-4-7-11(13)16/h2-8,17H,1H3,(H,18,19).
What are the key properties of N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide?
N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide has a molecular weight of 323.17 g/mol, XLogP of 3.88, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide is sourced from PubChem (CID 107601184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).