(E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine

C15H14N2O — CID 54606331

IUPAC(E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine
SMILESCC(=C/c1ccccc1)/C=N/N=C/c1ccco1
InChIInChI=1S/C15H14N2O/c1-13(10-14-6-3-2-4-7-14)11-16-17-12-15-8-5-9-18-15/h2-12H,1H3/b13-10-,16-11+,17-12+
InChIKeyZIDYHMWVTDAEMM-RPNUOTCHSA-N
MW238.29 g/mol
LogP3.79
Rot. Bonds4

About (E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine

(E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine (PubChem CID 54606331) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is (E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine.

Molecular Properties

Compound Name(E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine
PubChem CID54606331
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name(E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine
SMILESCC(=C/c1ccccc1)/C=N/N=C/c1ccco1
InChIInChI=1S/C15H14N2O/c1-13(10-14-6-3-2-4-7-14)11-16-17-12-15-8-5-9-18-15/h2-12H,1H3/b13-10-,16-11+,17-12+
InChIKeyZIDYHMWVTDAEMM-RPNUOTCHSA-N
XLogP3.79
TPSA37.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.79
H-Bond Donors ≤ 50
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

(E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine
CID 46707076
2-[(Z)-[(E)-furan-2-ylmethylidenehydrazinylidene]methyl]phenol
CID 135478746
ethane;1-(furan-2-yl)-N-phenylmethanimine
CID 160534475
(Z)-N-[(Z)-furan-2-ylmethylideneamino]-1-(4-phenylmethoxyphenyl)methanimine
CID 6306571
(Z)-1-(3-bromophenyl)-N-[(E)-furan-2-ylmethylideneamino]methanimine
CID 54610300
(E)-1-(furan-2-yl)-N-[(Z)-[2,3,5,6-tetrachloro-4-[(E)-[(Z)-furan-2-ylmethylidenehydrazinylidene]methyl]phenyl]methylideneamino]methanimine
CID 54606337
(E)-1-(2-chlorophenyl)-N-[(Z)-furan-2-ylmethylideneamino]methanimine
CID 92523787
N-[3-[2-(furan-2-ylmethylidene)hydrazinyl]-3-oxo-1-phenylprop-1-en-2-yl]benzamide
CID 3324934
2-[(E)-2-phenylethenyl]furan
CID 642118
(E,E)-3-(furan-2-yl)-2-methyl-N-(1,2,4-triazol-4-yl)prop-2-en-1-imine
CID 6878580
(Z)-1-(2-ethoxyphenyl)-N-[(E)-furan-2-ylmethylideneamino]methanimine
CID 54601550
(2E)-2-benzylidene-N-[(E)-furan-2-ylmethylideneamino]-4-hydroxybutanamide
CID 6880952

Frequently Asked Questions

What is the IUPAC name of (E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine?
The IUPAC name of (E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine (CID 54606331) is (E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine.
What is the SMILES notation for (E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine?
The canonical SMILES for (E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine is CC(=C/c1ccccc1)/C=N/N=C/c1ccco1.
What is the InChIKey of (E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine?
The InChIKey is ZIDYHMWVTDAEMM-RPNUOTCHSA-N. The full InChI is InChI=1S/C15H14N2O/c1-13(10-14-6-3-2-4-7-14)11-16-17-12-15-8-5-9-18-15/h2-12H,1H3/b13-10-,16-11+,17-12+.
What are the key properties of (E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine?
(E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine has a molecular weight of 238.29 g/mol, XLogP of 3.79, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine is sourced from PubChem (CID 54606331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).