2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole

C11H6BrFN2O — CID 13004835

IUPAC2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole
SMILESFc1ccc2nc(-c3ccc(Br)o3)[nH]c2c1
InChIInChI=1S/C11H6BrFN2O/c12-10-4-3-9(16-10)11-14-7-2-1-6(13)5-8(7)15-11/h1-5H,(H,14,15)
InChIKeyBROCLSPHUVGXKJ-UHFFFAOYSA-N
MW281.08 g/mol
LogP3.72
Rot. Bonds1

About 2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole

2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole (PubChem CID 13004835) has the molecular formula C11H6BrFN2O and a molecular weight of 281.08 g/mol. Its IUPAC name is 2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole.

Molecular Properties

Compound Name2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole
PubChem CID13004835
Molecular FormulaC11H6BrFN2O
Molecular Weight281.08 g/mol
Exact Mass279.96
IUPAC Name2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole
SMILESFc1ccc2nc(-c3ccc(Br)o3)[nH]c2c1
InChIInChI=1S/C11H6BrFN2O/c12-10-4-3-9(16-10)11-14-7-2-1-6(13)5-8(7)15-11/h1-5H,(H,14,15)
InChIKeyBROCLSPHUVGXKJ-UHFFFAOYSA-N
XLogP3.72
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.08
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-bromofuran-2-yl)-6-(trifluoromethyl)-1H-benzimidazole
CID 112730249
6-bromo-2-(5-chlorofuran-2-yl)-1H-benzimidazole
CID 13004842
2-(3-bromo-2-fluorophenyl)-6-fluoro-1H-benzimidazole
CID 114020270
2-(2,6-difluorophenyl)-6-fluoro-1H-benzimidazole
CID 60979328
2-(4-bromo-2-methylphenyl)-6-fluoro-1H-benzimidazole
CID 64724742
2-bromo-4-(6-fluoro-1H-benzimidazol-2-yl)phenol
CID 136837301
6-fluoro-2-pyrimidin-5-yl-1H-benzimidazole
CID 102922110
4-(6-fluoro-1H-benzimidazol-2-yl)aniline
CID 22387237
2-(2,6-dichlorophenyl)-6-fluoro-1H-benzimidazole
CID 60979200
6-fluoro-2-(2-phenylpyrimidin-5-yl)-1H-benzimidazole
CID 56796622
6-fluoro-2-(1-methylpyrazol-4-yl)-1H-benzimidazole
CID 60980673
6-fluoro-2-(4-methylsulfanylphenyl)-1H-benzimidazole
CID 112730258

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole?
The IUPAC name of 2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole (CID 13004835) is 2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole.
What is the SMILES notation for 2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole?
The canonical SMILES for 2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole is Fc1ccc2nc(-c3ccc(Br)o3)[nH]c2c1.
What is the InChIKey of 2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole?
The InChIKey is BROCLSPHUVGXKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrFN2O/c12-10-4-3-9(16-10)11-14-7-2-1-6(13)5-8(7)15-11/h1-5H,(H,14,15).
What are the key properties of 2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole?
2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole has a molecular weight of 281.08 g/mol, XLogP of 3.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromofuran-2-yl)-6-fluoro-1H-benzimidazole is sourced from PubChem (CID 13004835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).