(E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine

C12H10N2O — CID 46707076

IUPAC(E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine
SMILESC(=N/N=C/c1ccco1)\c1ccccc1
InChIInChI=1S/C12H10N2O/c1-2-5-11(6-3-1)9-13-14-10-12-7-4-8-15-12/h1-10H/b13-9+,14-10+
InChIKeyAXEXXMXSPRDAAP-UTLPMFLDSA-N
MW198.22 g/mol
LogP2.73
Rot. Bonds3

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

(E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine (PubChem CID 46707076) has the molecular formula C12H10N2O and a molecular weight of 198.22 g/mol. Its IUPAC name is (E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine.

Molecular Properties

Compound Name(E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine
PubChem CID46707076
Molecular FormulaC12H10N2O
Molecular Weight198.22 g/mol
Exact Mass198.08
IUPAC Name(E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine
SMILESC(=N/N=C/c1ccco1)\c1ccccc1
InChIInChI=1S/C12H10N2O/c1-2-5-11(6-3-1)9-13-14-10-12-7-4-8-15-12/h1-10H/b13-9+,14-10+
InChIKeyAXEXXMXSPRDAAP-UTLPMFLDSA-N
XLogP2.73
TPSA37.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 52.73
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

(Z)-1-(3-bromophenyl)-N-[(E)-furan-2-ylmethylideneamino]methanimine
CID 54610300
(Z)-N-[(Z)-furan-2-ylmethylideneamino]-1-(4-phenylmethoxyphenyl)methanimine
CID 6306571
(E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine
CID 54606331
2-[(Z)-[(E)-furan-2-ylmethylidenehydrazinylidene]methyl]phenol
CID 135478746
(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
2-[(E)-2-phenylethenyl]furan
CID 642118
1-(furan-2-yl)-N-[2-(furan-2-ylmethylideneamino)phenyl]methanimine
CID 10015655
ethane;1-(furan-2-yl)-N-phenylmethanimine
CID 160534475
1-(furan-2-yl)-N-oxidomethanimine
CID 135527449
(Z)-1-(2-ethoxyphenyl)-N-[(E)-furan-2-ylmethylideneamino]methanimine
CID 54601550
2-[(E)-2-bromoethenyl]furan
CID 10899150

Frequently Asked Questions

What is the IUPAC name of (E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine?
The IUPAC name of (E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine (CID 46707076) is (E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine.
What is the SMILES notation for (E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine?
The canonical SMILES for (E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine is C(=N/N=C/c1ccco1)\c1ccccc1.
What is the InChIKey of (E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine?
The InChIKey is AXEXXMXSPRDAAP-UTLPMFLDSA-N. The full InChI is InChI=1S/C12H10N2O/c1-2-5-11(6-3-1)9-13-14-10-12-7-4-8-15-12/h1-10H/b13-9+,14-10+.
What are the key properties of (E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine?
(E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine has a molecular weight of 198.22 g/mol, XLogP of 2.73, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine is sourced from PubChem (CID 46707076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).