(E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine

C23H19N3O — CID 71492478

IUPAC(E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine
SMILESC(=N/OCc1ccccc1)\C1=NC(c2ccccc2)N=C1c1ccccc1
InChIInChI=1S/C23H19N3O/c1-4-10-18(11-5-1)17-27-24-16-21-22(19-12-6-2-7-13-19)26-23(25-21)20-14-8-3-9-15-20/h1-16,23H,17H2/b24-16+
InChIKeyWGQZFVLABNWFDH-LFVJCYFKSA-N
MW353.43 g/mol
LogP4.83
Rot. Bonds6

About (E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine

(E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine (PubChem CID 71492478) has the molecular formula C23H19N3O and a molecular weight of 353.43 g/mol. Its IUPAC name is (E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine.

Molecular Properties

Compound Name(E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine
PubChem CID71492478
Molecular FormulaC23H19N3O
Molecular Weight353.43 g/mol
Exact Mass353.15
IUPAC Name(E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine
SMILESC(=N/OCc1ccccc1)\C1=NC(c2ccccc2)N=C1c1ccccc1
InChIInChI=1S/C23H19N3O/c1-4-10-18(11-5-1)17-27-24-16-21-22(19-12-6-2-7-13-19)26-23(25-21)20-14-8-3-9-15-20/h1-16,23H,17H2/b24-16+
InChIKeyWGQZFVLABNWFDH-LFVJCYFKSA-N
XLogP4.83
TPSA46.31 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

(2R,6S)-1-allyl-N-benzyloxy-2,6-diphenyl-piperidin-4-imine
CID 71458655
Benzyl(2-(benzyloxy)-1-phenylethyl)azane oxide
CID 6285465
3,5,5-Triphenyl-4,5-dihydro-1,2,4-oxadiazole
CID 1820203
4-benzyl-3,5-diphenyl-5H-1,2,4-oxadiazole
CID 12674725
1-phenyl-N-[(1S)-1-phenyl-2-phenylmethoxyethyl]methanimine oxide
CID 5466985
(E)-N-[(3-fluorophenyl)methyl]-N'-phenylmethoxyethane-1,2-diimine
CID 172947101
1-phenyl-N-[2-(5-phenyl-2,5-dihydro-1,2,4-oxadiazol-3-yl)ethyl]methanimine
CID 15695435
2-Methoxy-1-oxo-2,4,5-triphenyl-2H-1lambda~5~-imidazole
CID 71405490
5-Butyl-3,6-diphenyl-4,6-dihydro-1,2,5-oxadiazine
CID 86248628
(1R,2S)-2-(benzylideneamino)-1,2-diphenylethanol
CID 101237804
(1S,2R)-2-(benzylideneamino)-1,2-diphenylethanol
CID 101237805
1-phenyl-N-[(1R)-1-phenyl-2-phenylmethoxyethyl]methanimine
CID 101731359

Frequently Asked Questions

What is the IUPAC name of (E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine?
The IUPAC name of (E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine (CID 71492478) is (E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine.
What is the SMILES notation for (E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine?
The canonical SMILES for (E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine is C(=N/OCc1ccccc1)\C1=NC(c2ccccc2)N=C1c1ccccc1.
What is the InChIKey of (E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine?
The InChIKey is WGQZFVLABNWFDH-LFVJCYFKSA-N. The full InChI is InChI=1S/C23H19N3O/c1-4-10-18(11-5-1)17-27-24-16-21-22(19-12-6-2-7-13-19)26-23(25-21)20-14-8-3-9-15-20/h1-16,23H,17H2/b24-16+.
What are the key properties of (E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine?
(E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine has a molecular weight of 353.43 g/mol, XLogP of 4.83, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(2,5-diphenyl-2H-imidazol-4-yl)-N-phenylmethoxymethanimine is sourced from PubChem (CID 71492478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).