4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide

C15H9BrFNO2 — CID 84577804

IUPAC4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1cc2c(Br)cccc2o1
InChIInChI=1S/C15H9BrFNO2/c16-12-5-2-6-13-11(12)8-14(20-13)15(19)18-10-4-1-3-9(17)7-10/h1-8H,(H,18,19)
InChIKeyRHLWVXZVVFMAKC-UHFFFAOYSA-N
MW334.14 g/mol
LogP4.59
Rot. Bonds2

About 4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide

4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide (PubChem CID 84577804) has the molecular formula C15H9BrFNO2 and a molecular weight of 334.14 g/mol. Its IUPAC name is 4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide
PubChem CID84577804
Molecular FormulaC15H9BrFNO2
Molecular Weight334.14 g/mol
Exact Mass332.98
IUPAC Name4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1cc2c(Br)cccc2o1
InChIInChI=1S/C15H9BrFNO2/c16-12-5-2-6-13-11(12)8-14(20-13)15(19)18-10-4-1-3-9(17)7-10/h1-8H,(H,18,19)
InChIKeyRHLWVXZVVFMAKC-UHFFFAOYSA-N
XLogP4.59
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.14
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-N-(2-methyl-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide
CID 112525549
4-bromo-N-[2-(4-fluorophenyl)ethyl]-1-benzofuran-2-carboxamide
CID 112529086
5-fluoro-N-(3-methylphenyl)-1-benzofuran-2-carboxamide
CID 78843203
4-bromo-N-(2-oxo-3H-1,3-benzoxazol-7-yl)-1-benzofuran-2-carboxamide
CID 112522723
N-(3-bromophenyl)-1-benzofuran-2-carboxamide
CID 802478
3-bromo-4-fluoro-N-(3-fluorophenyl)benzamide
CID 103706269
5-ethyl-N-(3-fluorophenyl)furan-2-carboxamide
CID 110697812
4-bromo-N-[2-(4-bromophenyl)ethyl]-1-benzofuran-2-carboxamide
CID 112529138
2,3,5,6-tetrafluoro-1-N,4-N-bis(3-fluorophenyl)benzene-1,4-dicarboxamide
CID 3094065
N-(3-fluorophenyl)-1,3-oxazole-5-carboxamide
CID 96596303
N-(3-fluorophenyl)-2-oxo-1,3-benzodioxole-4-carboxamide
CID 56970493
5-(1-chloroethyl)-N-(3-fluorophenyl)furan-2-carboxamide
CID 82109811

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide?
The IUPAC name of 4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide (CID 84577804) is 4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for 4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for 4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide is O=C(Nc1cccc(F)c1)c1cc2c(Br)cccc2o1.
What is the InChIKey of 4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide?
The InChIKey is RHLWVXZVVFMAKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9BrFNO2/c16-12-5-2-6-13-11(12)8-14(20-13)15(19)18-10-4-1-3-9(17)7-10/h1-8H,(H,18,19).
What are the key properties of 4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide?
4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide has a molecular weight of 334.14 g/mol, XLogP of 4.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(3-fluorophenyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 84577804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).