N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide

C14H10N2O3 — CID 6888261

IUPACN-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide
SMILESO=C(N/N=C/c1ccco1)c1cc2ccccc2o1
InChIInChI=1S/C14H10N2O3/c17-14(16-15-9-11-5-3-7-18-11)13-8-10-4-1-2-6-12(10)19-13/h1-9H,(H,16,17)/b15-9+
InChIKeyACVNKFNHLGUSKG-OQLLNIDSSA-N
MW254.25 g/mol
LogP2.79
Rot. Bonds3

About N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide

N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide (PubChem CID 6888261) has the molecular formula C14H10N2O3 and a molecular weight of 254.25 g/mol. Its IUPAC name is N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide
PubChem CID6888261
Molecular FormulaC14H10N2O3
Molecular Weight254.25 g/mol
Exact Mass254.07
IUPAC NameN-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide
SMILESO=C(N/N=C/c1ccco1)c1cc2ccccc2o1
InChIInChI=1S/C14H10N2O3/c17-14(16-15-9-11-5-3-7-18-11)13-8-10-4-1-2-6-12(10)19-13/h1-9H,(H,16,17)/b15-9+
InChIKeyACVNKFNHLGUSKG-OQLLNIDSSA-N
XLogP2.79
TPSA67.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-[(E)-phenylmethylidene]furan-2-carbohydrazide
CID 6869164
N'-(1-naphthylmethylene)-1-benzofuran-2-carbohydrazide
CID 6873935
N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1-benzofuran-2-carboxamide
CID 6867648
N-[(E)-(4-methylphenyl)methylideneamino]furan-2-carboxamide
CID 6870919
N'-[(1E,2Z)-3-(2-methoxyphenyl)prop-2-enylidene]-2-furohydrazide
CID 6878929
(E)-N'-(4-(benzyloxy)benzylidene)furan-2-carbohydrazide
CID 6880344
N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-1-benzofuran-2-carboxamide
CID 6886843
N'-[(4-oxo-4H-chromen-3-yl)methylene]-1-benzofuran-2-carbohydrazide
CID 9557333
N'-[(1E,2E)-2-methyl-3-phenylprop-2-enylidene]-2-furohydrazide
CID 9613794
N-[(E)-[(E)-3-(2-methoxyphenyl)prop-2-enylidene]amino]furan-2-carboxamide
CID 6878930
N'-[(E)-(2-hydroxyphenyl)methylidene]furan-2-carbohydrazide
CID 135479643
N-(benzo[d]furan-2-ylcarbonylamino)-2-phenoxyacetamide
CID 725695

Frequently Asked Questions

What is the IUPAC name of N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide?
The IUPAC name of N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide (CID 6888261) is N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide is O=C(N/N=C/c1ccco1)c1cc2ccccc2o1.
What is the InChIKey of N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide?
The InChIKey is ACVNKFNHLGUSKG-OQLLNIDSSA-N. The full InChI is InChI=1S/C14H10N2O3/c17-14(16-15-9-11-5-3-7-18-11)13-8-10-4-1-2-6-12(10)19-13/h1-9H,(H,16,17)/b15-9+.
What are the key properties of N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide?
N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide has a molecular weight of 254.25 g/mol, XLogP of 2.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-furan-2-ylmethylideneamino]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 6888261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).