(E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine

C20H17NO — CID 56678914

IUPAC(E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine
SMILESC(=N/OCc1ccccc1)\c1ccccc1-c1ccccc1
InChIInChI=1S/C20H17NO/c1-3-9-17(10-4-1)16-22-21-15-19-13-7-8-14-20(19)18-11-5-2-6-12-18/h1-15H,16H2/b21-15+
InChIKeyNHWLYUCXFIHYHE-RCCKNPSSSA-N
MW287.36 g/mol
LogP4.90
Rot. Bonds5

About (E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine

(E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine (PubChem CID 56678914) has the molecular formula C20H17NO and a molecular weight of 287.36 g/mol. Its IUPAC name is (E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine.

Molecular Properties

Compound Name(E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine
PubChem CID56678914
Molecular FormulaC20H17NO
Molecular Weight287.36 g/mol
Exact Mass287.13
IUPAC Name(E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine
SMILESC(=N/OCc1ccccc1)\c1ccccc1-c1ccccc1
InChIInChI=1S/C20H17NO/c1-3-9-17(10-4-1)16-22-21-15-19-13-7-8-14-20(19)18-11-5-2-6-12-18/h1-15H,16H2/b21-15+
InChIKeyNHWLYUCXFIHYHE-RCCKNPSSSA-N
XLogP4.90
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 54.90
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)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine?
The IUPAC name of (E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine (CID 56678914) is (E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine.
What is the SMILES notation for (E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine?
The canonical SMILES for (E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine is C(=N/OCc1ccccc1)\c1ccccc1-c1ccccc1.
What is the InChIKey of (E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine?
The InChIKey is NHWLYUCXFIHYHE-RCCKNPSSSA-N. The full InChI is InChI=1S/C20H17NO/c1-3-9-17(10-4-1)16-22-21-15-19-13-7-8-14-20(19)18-11-5-2-6-12-18/h1-15H,16H2/b21-15+.
What are the key properties of (E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine?
(E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine has a molecular weight of 287.36 g/mol, XLogP of 4.90, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-phenylmethoxy-1-(2-phenylphenyl)methanimine is sourced from PubChem (CID 56678914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).