N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide

C16H11N3O2 — CID 2583514

IUPACN-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1nc2ccccc2[nH]1)c1cc2ccccc2o1
InChIInChI=1S/C16H11N3O2/c20-15(14-9-10-5-1-4-8-13(10)21-14)19-16-17-11-6-2-3-7-12(11)18-16/h1-9H,(H2,17,18,19,20)
InChIKeyNAZWMGNYMJBXAY-UHFFFAOYSA-N
MW277.28 g/mol
LogP3.56
Rot. Bonds2

About N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide

N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide (PubChem CID 2583514) has the molecular formula C16H11N3O2 and a molecular weight of 277.28 g/mol. Its IUPAC name is N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide
PubChem CID2583514
Molecular FormulaC16H11N3O2
Molecular Weight277.28 g/mol
Exact Mass277.09
IUPAC NameN-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide
SMILESO=C(Nc1nc2ccccc2[nH]1)c1cc2ccccc2o1
InChIInChI=1S/C16H11N3O2/c20-15(14-9-10-5-1-4-8-13(10)21-14)19-16-17-11-6-2-3-7-12(11)18-16/h1-9H,(H2,17,18,19,20)
InChIKeyNAZWMGNYMJBXAY-UHFFFAOYSA-N
XLogP3.56
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.28
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide (CID 2583514) is N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide is O=C(Nc1nc2ccccc2[nH]1)c1cc2ccccc2o1.
What is the InChIKey of N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide?
The InChIKey is NAZWMGNYMJBXAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3O2/c20-15(14-9-10-5-1-4-8-13(10)21-14)19-16-17-11-6-2-3-7-12(11)18-16/h1-9H,(H2,17,18,19,20).
What are the key properties of N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide?
N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide has a molecular weight of 277.28 g/mol, XLogP of 3.56, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-benzimidazol-2-yl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 2583514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).