7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide

C15H8BrF2NO2 — CID 38897845

IUPAC7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1cc(F)ccc1F)c1cc2cccc(Br)c2o1
InChIInChI=1S/C15H8BrF2NO2/c16-10-3-1-2-8-6-13(21-14(8)10)15(20)19-12-7-9(17)4-5-11(12)18/h1-7H,(H,19,20)
InChIKeyDMDWSFJTIVEKDR-UHFFFAOYSA-N
MW352.13 g/mol
LogP4.73
Rot. Bonds2

About 7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide

7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide (PubChem CID 38897845) has the molecular formula C15H8BrF2NO2 and a molecular weight of 352.13 g/mol. Its IUPAC name is 7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide
PubChem CID38897845
Molecular FormulaC15H8BrF2NO2
Molecular Weight352.13 g/mol
Exact Mass350.97
IUPAC Name7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1cc(F)ccc1F)c1cc2cccc(Br)c2o1
InChIInChI=1S/C15H8BrF2NO2/c16-10-3-1-2-8-6-13(21-14(8)10)15(20)19-12-7-9(17)4-5-11(12)18/h1-7H,(H,19,20)
InChIKeyDMDWSFJTIVEKDR-UHFFFAOYSA-N
XLogP4.73
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.13
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 3-[(7-bromo-1-benzofuran-2-carbonyl)amino]-4-fluorobenzoate
CID 38939880
7-bromo-N-(2-methylsulfanylphenyl)-1-benzofuran-2-carboxamide
CID 46450792
7-bromo-N-(2,3-dimethylphenyl)-1-benzofuran-2-carboxamide
CID 38885789
N-(4-acetamidophenyl)-7-bromo-1-benzofuran-2-carboxamide
CID 39705718
7-bromo-N-[2-(3-fluorophenyl)ethyl]-1-benzofuran-2-carboxamide
CID 38930964
N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide
CID 48980668
methyl 3-[(7-bromo-1-benzofuran-2-carbonyl)amino]thiophene-2-carboxylate
CID 38928922
7-bromo-N-(5-chloro-2-morpholin-4-ylphenyl)-1-benzofuran-2-carboxamide
CID 38910561
1-(7-bromo-1-benzofuran-2-yl)-2-(4-fluorophenyl)ethanone
CID 105078433
7-bromo-N-quinolin-3-yl-1-benzofuran-2-carboxamide
CID 38938978
7-bromo-N-(5-methyl-1H-pyrazol-3-yl)-1-benzofuran-2-carboxamide
CID 47289802
methyl 3-[(7-bromo-1-benzofuran-2-carbonyl)amino]-4-methylbenzoate
CID 38908619

Frequently Asked Questions

What is the IUPAC name of 7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide?
The IUPAC name of 7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide (CID 38897845) is 7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for 7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for 7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide is O=C(Nc1cc(F)ccc1F)c1cc2cccc(Br)c2o1.
What is the InChIKey of 7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide?
The InChIKey is DMDWSFJTIVEKDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8BrF2NO2/c16-10-3-1-2-8-6-13(21-14(8)10)15(20)19-12-7-9(17)4-5-11(12)18/h1-7H,(H,19,20).
What are the key properties of 7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide?
7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide has a molecular weight of 352.13 g/mol, XLogP of 4.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 38897845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).