5-(1-benzofuran-2-yl)furan-2-carboxamide

C13H9NO3 — CID 90769310

IUPAC5-(1-benzofuran-2-yl)furan-2-carboxamide
SMILESNC(=O)c1ccc(-c2cc3ccccc3o2)o1
InChIInChI=1S/C13H9NO3/c14-13(15)11-6-5-10(17-11)12-7-8-3-1-2-4-9(8)16-12/h1-7H,(H2,14,15)
InChIKeyRQFGJXOQYIMYQV-UHFFFAOYSA-N
MW227.22 g/mol
LogP2.79
Rot. Bonds2

About 5-(1-benzofuran-2-yl)furan-2-carboxamide

5-(1-benzofuran-2-yl)furan-2-carboxamide (PubChem CID 90769310) has the molecular formula C13H9NO3 and a molecular weight of 227.22 g/mol. Its IUPAC name is 5-(1-benzofuran-2-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(1-benzofuran-2-yl)furan-2-carboxamide
PubChem CID90769310
Molecular FormulaC13H9NO3
Molecular Weight227.22 g/mol
Exact Mass227.06
IUPAC Name5-(1-benzofuran-2-yl)furan-2-carboxamide
SMILESNC(=O)c1ccc(-c2cc3ccccc3o2)o1
InChIInChI=1S/C13H9NO3/c14-13(15)11-6-5-10(17-11)12-7-8-3-1-2-4-9(8)16-12/h1-7H,(H2,14,15)
InChIKeyRQFGJXOQYIMYQV-UHFFFAOYSA-N
XLogP2.79
TPSA69.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.22
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzofuran-2-carboxamide;hydrate;dihydrochloride
CID 144595737
1-(1-benzofuran-2-yl)ethanone
CID 15435
[1-benzofuran-2-yl(methoxy)methylidene]chromium
CID 134878936
methyl 2-(1-benzofuran-2-carbonylamino)propanoate
CID 19167935
(2S)-2-amino-3-[4-(1-benzofuran-2-yl)phenyl]propanoic acid
CID 68534596
6-(1-benzofuran-2-yl)-1,3-benzodioxole-5-carboxamide
CID 56708499
(4-methoxyphenyl) 1-benzofuran-2-carboxylate
CID 659898
ethyl 5-(1-benzofuran-2-yl)-1,2-oxazole-3-carboxylate
CID 154791615
(2-bromophenyl) 1-benzofuran-2-carboxylate
CID 17391637
[(E)-1-(1-benzofuran-2-yl)ethylideneamino] acetate
CID 53467236
4-aminobenzamide;1-benzofuran-2-carboxylic acid
CID 70131943
1-(1-benzofuran-2-yl)-2-(6-methoxy-3-pyridinyl)ethanone
CID 114725771

Frequently Asked Questions

What is the IUPAC name of 5-(1-benzofuran-2-yl)furan-2-carboxamide?
The IUPAC name of 5-(1-benzofuran-2-yl)furan-2-carboxamide (CID 90769310) is 5-(1-benzofuran-2-yl)furan-2-carboxamide.
What is the SMILES notation for 5-(1-benzofuran-2-yl)furan-2-carboxamide?
The canonical SMILES for 5-(1-benzofuran-2-yl)furan-2-carboxamide is NC(=O)c1ccc(-c2cc3ccccc3o2)o1.
What is the InChIKey of 5-(1-benzofuran-2-yl)furan-2-carboxamide?
The InChIKey is RQFGJXOQYIMYQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9NO3/c14-13(15)11-6-5-10(17-11)12-7-8-3-1-2-4-9(8)16-12/h1-7H,(H2,14,15).
What are the key properties of 5-(1-benzofuran-2-yl)furan-2-carboxamide?
5-(1-benzofuran-2-yl)furan-2-carboxamide has a molecular weight of 227.22 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-benzofuran-2-yl)furan-2-carboxamide is sourced from PubChem (CID 90769310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).