(E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine

C24H21N3O — CID 5482480

IUPAC(E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine
SMILESc1ccc(/C(Cn2ccnc2)=N\OCc2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C24H21N3O/c1-3-7-21(8-4-1)22-13-11-20(12-14-22)18-28-26-24(17-27-16-15-25-19-27)23-9-5-2-6-10-23/h1-16,19H,17-18H2/b26-24-
InChIKeyVXXUNDFYLYWQKH-LCUIJRPUSA-N
MW367.45 g/mol
LogP5.17
Rot. Bonds7

About (E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine

(E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine (PubChem CID 5482480) has the molecular formula C24H21N3O and a molecular weight of 367.45 g/mol. Its IUPAC name is (E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine.

Molecular Properties

Compound Name(E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine
PubChem CID5482480
Molecular FormulaC24H21N3O
Molecular Weight367.45 g/mol
Exact Mass367.17
IUPAC Name(E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine
SMILESc1ccc(/C(Cn2ccnc2)=N\OCc2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C24H21N3O/c1-3-7-21(8-4-1)22-13-11-20(12-14-22)18-28-26-24(17-27-16-15-25-19-27)23-9-5-2-6-10-23/h1-16,19H,17-18H2/b26-24-
InChIKeyVXXUNDFYLYWQKH-LCUIJRPUSA-N
XLogP5.17
TPSA39.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.45
LogP ≤ 55.17
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

alpha-(4-(2-Phenylethyl)phenyl)-1H-imidazole-1-ethanol
CID 53626
Denzimol hydrochloride
CID 53625
1-(4-methylphenyl)-1-phenyl-2-[1-(1-propenyl)-1H-imidazol-2-yl]ethanol
CID 6270550
Imidazole-1-ethanol, alpha-(4-cyclohexylphenyl)-, monohydrochloride
CID 3059786
1-(Biphenyl-3-yl)-2-(1h-imidazol-1-yl)ethanol
CID 52776
Denzimol, (S)-
CID 76965185
1-[[4-(1,1-Dimethylethyl)phenyl]methoxy]-1H-imidazole
CID 1491084
1-(4-Biphenylyl)-1-(4-fluorophenyl)-2-(imidazol-1-yl)-ethanol
CID 13013626
1-(3,3-Diphenyl-3-hydroxypropyl)-1H-imidazole
CID 24895248
1-([1,1'-Biphenyl]-4-yl)-2-(1H-imidazol-1-yl)propan-1-ol--hydrogen chloride (1/1)
CID 45262803
1-([1,1'-Biphenyl]-4-yl)-2-(1H-imidazol-1-yl)ethan-1-ol--hydrogen chloride (1/1)
CID 45265399
(E)-5-chloro-N-[(3-chlorophenyl)methoxy]-2-(imidazol-1-ylmethyl)-3,4-dihydro-2H-naphthalen-1-imine
CID 137649018

Frequently Asked Questions

What is the IUPAC name of (E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine?
The IUPAC name of (E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine (CID 5482480) is (E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine.
What is the SMILES notation for (E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine?
The canonical SMILES for (E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine is c1ccc(/C(Cn2ccnc2)=N\OCc2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of (E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine?
The InChIKey is VXXUNDFYLYWQKH-LCUIJRPUSA-N. The full InChI is InChI=1S/C24H21N3O/c1-3-7-21(8-4-1)22-13-11-20(12-14-22)18-28-26-24(17-27-16-15-25-19-27)23-9-5-2-6-10-23/h1-16,19H,17-18H2/b26-24-.
What are the key properties of (E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine?
(E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine has a molecular weight of 367.45 g/mol, XLogP of 5.17, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-imidazol-1-yl-1-phenyl-N-[(4-phenylphenyl)methoxy]ethanimine is sourced from PubChem (CID 5482480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).