N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide

C14H12N2O2 — CID 92534270

IUPACN-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide
SMILESO=C(N/N=C/C=C\c1ccccc1)c1ccco1
InChIInChI=1S/C14H12N2O2/c17-14(13-9-5-11-18-13)16-15-10-4-8-12-6-2-1-3-7-12/h1-11H,(H,16,17)/b8-4-,15-10+
InChIKeyPROWJSOMZWKJHN-JBCREXSLSA-N
MW240.26 g/mol
LogP2.71
Rot. Bonds4

About N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide

N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide (PubChem CID 92534270) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide
PubChem CID92534270
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC NameN-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide
SMILESO=C(N/N=C/C=C\c1ccccc1)c1ccco1
InChIInChI=1S/C14H12N2O2/c17-14(13-9-5-11-18-13)16-15-10-4-8-12-6-2-1-3-7-12/h1-11H,(H,16,17)/b8-4-,15-10+
InChIKeyPROWJSOMZWKJHN-JBCREXSLSA-N
XLogP2.71
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

1,3-bis(cinnamylideneamino)urea
CID 2823909
N-(cinnamylideneamino)-2-phenylacetamide
CID 562559
N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]-1-benzofuran-2-carboxamide
CID 96889885
1-[(E)-cinnamylideneamino]-3-methylurea
CID 167350066
[(E)-[(Z)-3-phenylprop-2-enylidene]amino]urea
CID 92529945
N-(cinnamylideneamino)-2-iodobenzamide
CID 4982683
4-benzamido-N-(cinnamylideneamino)benzamide
CID 5097860
N-[(Z)-(4-hydroxyphenyl)methylideneamino]furan-2-carboxamide
CID 136661630
N-(pyridin-4-ylmethylideneamino)furan-2-carboxamide
CID 678532
copper N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]benzo[e][1]benzofuran-2-carboxamide
CID 86575254
N-[(E)-(3-hydroxyphenyl)methylideneamino]furan-2-carboxamide
CID 6885887
5-phenyl-N-[[(Z)-3-phenylprop-2-enylidene]amino]-1,3,4-oxadiazole-2-carboxamide
CID 129431951

Frequently Asked Questions

What is the IUPAC name of N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide?
The IUPAC name of N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide (CID 92534270) is N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide.
What is the SMILES notation for N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide?
The canonical SMILES for N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide is O=C(N/N=C/C=C\c1ccccc1)c1ccco1.
What is the InChIKey of N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide?
The InChIKey is PROWJSOMZWKJHN-JBCREXSLSA-N. The full InChI is InChI=1S/C14H12N2O2/c17-14(13-9-5-11-18-13)16-15-10-4-8-12-6-2-1-3-7-12/h1-11H,(H,16,17)/b8-4-,15-10+.
What are the key properties of N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide?
N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide has a molecular weight of 240.26 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide is sourced from PubChem (CID 92534270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).