N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide

C13H7BrF3NO — CID 103741269

IUPACN-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide
SMILESO=C(Nc1c(F)cccc1Br)c1cccc(F)c1F
InChIInChI=1S/C13H7BrF3NO/c14-8-4-2-6-10(16)12(8)18-13(19)7-3-1-5-9(15)11(7)17/h1-6H,(H,18,19)
InChIKeyPPJFJWJWMFLXEK-UHFFFAOYSA-N
MW330.10 g/mol
LogP4.12
Rot. Bonds2

About N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide

N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide (PubChem CID 103741269) has the molecular formula C13H7BrF3NO and a molecular weight of 330.10 g/mol. Its IUPAC name is N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide.

Molecular Properties

Compound NameN-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide
PubChem CID103741269
Molecular FormulaC13H7BrF3NO
Molecular Weight330.10 g/mol
Exact Mass328.97
IUPAC NameN-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide
SMILESO=C(Nc1c(F)cccc1Br)c1cccc(F)c1F
InChIInChI=1S/C13H7BrF3NO/c14-8-4-2-6-10(16)12(8)18-13(19)7-3-1-5-9(15)11(7)17/h1-6H,(H,18,19)
InChIKeyPPJFJWJWMFLXEK-UHFFFAOYSA-N
XLogP4.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.10
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-bromo-6-fluorophenyl)-2,3-difluoropyridine-4-carboxamide
CID 107470490
3-amino-2-bromo-N-(2-bromo-6-fluorophenyl)benzamide
CID 107596264
N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide
CID 107601184
N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide
CID 107598701
N-(4-bromo-2,6-difluorophenyl)-2,3-difluorobenzamide
CID 65469148
N-(2-bromo-6-fluorophenyl)-2-fluoro-4-hydroxybenzamide
CID 107676888
2-bromo-N-(2-bromo-6-fluorophenyl)-4-chlorobenzamide
CID 103765558
2-amino-N-(2-bromo-6-fluorophenyl)-5-fluorobenzamide
CID 107596162
N-(2-bromo-6-fluorophenyl)acetamide
CID 59145529
N-(2-bromo-6-fluorophenyl)-4-fluorobenzamide
CID 103741284
2-bromo-N-(2-bromo-6-fluorophenyl)-5-nitrobenzamide
CID 103741282
3-bromo-N-(2,6-dichlorophenyl)-2-fluorobenzamide
CID 107951647

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide?
The IUPAC name of N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide (CID 103741269) is N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide.
What is the SMILES notation for N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide?
The canonical SMILES for N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide is O=C(Nc1c(F)cccc1Br)c1cccc(F)c1F.
What is the InChIKey of N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide?
The InChIKey is PPJFJWJWMFLXEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7BrF3NO/c14-8-4-2-6-10(16)12(8)18-13(19)7-3-1-5-9(15)11(7)17/h1-6H,(H,18,19).
What are the key properties of N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide?
N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide has a molecular weight of 330.10 g/mol, XLogP of 4.12, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide is sourced from PubChem (CID 103741269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).