(E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine

C16H16N2 — CID 5484329

IUPAC(E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine
SMILESC/C(=N\N=C(/C)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H16N2/c1-13(15-9-5-3-6-10-15)17-18-14(2)16-11-7-4-8-12-16/h3-12H,1-2H3/b17-13+,18-14+
InChIKeyMOKMQSIJAHPSQX-HBKJEHTGSA-N
MW236.32 g/mol
LogP3.92
Rot. Bonds3

About (E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine

(E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine (PubChem CID 5484329) has the molecular formula C16H16N2 and a molecular weight of 236.32 g/mol. Its IUPAC name is (E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine.

Molecular Properties

Compound Name(E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine
PubChem CID5484329
Molecular FormulaC16H16N2
Molecular Weight236.32 g/mol
Exact Mass236.13
IUPAC Name(E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine
SMILESC/C(=N\N=C(/C)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H16N2/c1-13(15-9-5-3-6-10-15)17-18-14(2)16-11-7-4-8-12-16/h3-12H,1-2H3/b17-13+,18-14+
InChIKeyMOKMQSIJAHPSQX-HBKJEHTGSA-N
XLogP3.92
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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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Frequently Asked Questions

What is the IUPAC name of (E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine?
The IUPAC name of (E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine (CID 5484329) is (E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine.
What is the SMILES notation for (E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine?
The canonical SMILES for (E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine is C/C(=N\N=C(/C)c1ccccc1)c1ccccc1.
What is the InChIKey of (E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine?
The InChIKey is MOKMQSIJAHPSQX-HBKJEHTGSA-N. The full InChI is InChI=1S/C16H16N2/c1-13(15-9-5-3-6-10-15)17-18-14(2)16-11-7-4-8-12-16/h3-12H,1-2H3/b17-13+,18-14+.
What are the key properties of (E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine?
(E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine has a molecular weight of 236.32 g/mol, XLogP of 3.92, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-phenyl-N-[(E)-1-phenylethylideneamino]ethanimine is sourced from PubChem (CID 5484329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).