2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol

C11H7ClN2O2 — CID 106688315

IUPAC2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol
SMILESOc1ccc2nc(-c3ccoc3Cl)[nH]c2c1
InChIInChI=1S/C11H7ClN2O2/c12-10-7(3-4-16-10)11-13-8-2-1-6(15)5-9(8)14-11/h1-5,15H,(H,13,14)
InChIKeyWKGCAHOSKJSOOJ-UHFFFAOYSA-N
MW234.64 g/mol
LogP3.18
Rot. Bonds1

About 2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol

2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol (PubChem CID 106688315) has the molecular formula C11H7ClN2O2 and a molecular weight of 234.64 g/mol. Its IUPAC name is 2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol.

Molecular Properties

Compound Name2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol
PubChem CID106688315
Molecular FormulaC11H7ClN2O2
Molecular Weight234.64 g/mol
Exact Mass234.02
IUPAC Name2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol
SMILESOc1ccc2nc(-c3ccoc3Cl)[nH]c2c1
InChIInChI=1S/C11H7ClN2O2/c12-10-7(3-4-16-10)11-13-8-2-1-6(15)5-9(8)14-11/h1-5,15H,(H,13,14)
InChIKeyWKGCAHOSKJSOOJ-UHFFFAOYSA-N
XLogP3.18
TPSA62.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.64
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylfuran-3-yl)-3H-benzimidazol-5-ol
CID 81432681
2-(2-chlorofuran-3-yl)-5,6-dimethoxy-1H-benzimidazole
CID 106688276
4-(6-chloro-1H-benzimidazol-2-yl)benzene-1,3-diol
CID 136903703
2-(5-amino-2-chlorophenyl)-3H-benzimidazol-5-ol
CID 81431500
2-(2-chlorofuran-3-yl)-6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazole
CID 106688273
2-(2-bromophenyl)-3H-benzimidazol-5-ol
CID 81431199
2-(2-iodophenyl)-3H-benzimidazol-5-ol
CID 81431209
2-(3-hydroxy-2-methylphenyl)-3H-benzimidazol-5-ol
CID 82829837
2-(2,5-difluorophenyl)-3H-benzimidazol-5-ol
CID 81432602
2-(5-bromo-2-methylphenyl)-3H-benzimidazol-5-ol
CID 81432484
2-naphthalen-1-yl-3H-benzimidazol-5-ol
CID 81432399
2-(2-amino-3,5-dimethylphenyl)-3H-benzimidazol-5-ol
CID 81432836

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol?
The IUPAC name of 2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol (CID 106688315) is 2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol.
What is the SMILES notation for 2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol?
The canonical SMILES for 2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol is Oc1ccc2nc(-c3ccoc3Cl)[nH]c2c1.
What is the InChIKey of 2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol?
The InChIKey is WKGCAHOSKJSOOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClN2O2/c12-10-7(3-4-16-10)11-13-8-2-1-6(15)5-9(8)14-11/h1-5,15H,(H,13,14).
What are the key properties of 2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol?
2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol has a molecular weight of 234.64 g/mol, XLogP of 3.18, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorofuran-3-yl)-3H-benzimidazol-5-ol is sourced from PubChem (CID 106688315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).