2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine

C32H23NO2 — CID 118642834

IUPAC2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine
SMILESC(=Nc1ccccc1)=C(c1ccccc1)c1cc(Oc2ccccc2)ccc1Oc1ccccc1
InChIInChI=1S/C32H23NO2/c1-5-13-25(14-6-1)31(24-33-26-15-7-2-8-16-26)30-23-29(34-27-17-9-3-10-18-27)21-22-32(30)35-28-19-11-4-12-20-28/h1-23H
InChIKeyFOYMDRCLYKPPRS-UHFFFAOYSA-N
MW453.54 g/mol
LogP8.70
Rot. Bonds7

About 2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine

2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine (PubChem CID 118642834) has the molecular formula C32H23NO2 and a molecular weight of 453.54 g/mol. Its IUPAC name is 2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine.

Molecular Properties

Compound Name2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine
PubChem CID118642834
Molecular FormulaC32H23NO2
Molecular Weight453.54 g/mol
Exact Mass453.17
IUPAC Name2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine
SMILESC(=Nc1ccccc1)=C(c1ccccc1)c1cc(Oc2ccccc2)ccc1Oc1ccccc1
InChIInChI=1S/C32H23NO2/c1-5-13-25(14-6-1)31(24-33-26-15-7-2-8-16-26)30-23-29(34-27-17-9-3-10-18-27)21-22-32(30)35-28-19-11-4-12-20-28/h1-23H
InChIKeyFOYMDRCLYKPPRS-UHFFFAOYSA-N
XLogP8.70
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500453.54
LogP ≤ 58.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2-bis(2-methoxy-4-phenoxyphenyl)-N-phenylethenimine;2,2-bis(2-methoxy-5-phenylphenyl)-N-phenylethenimine;2,2-bis[2-methoxy-5-(2-phenylpropan-2-yl)phenyl]-N-phenylethenimine;2,2-bis[2-phenoxy-5-(2-phenylpropan-2-yl)phenyl]-N-phenylethenimine
CID 160903270
[4-[2-[4-(hydroxymethyl)-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-1,2-bis[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]ethyl]-2-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol
CID 118642802
1-isothiocyanato-3-phenoxybenzene
CID 22041281
1,4-bis(4-isocyanatophenoxy)-2-[(E)-2-phenylethenyl]benzene
CID 21195110
[4-[1-[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]-1-phenylethyl]-2-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol
CID 118642786
[4-[9-[4-methoxy-3-(1-phenyl-2-phenyliminoethenyl)phenyl]fluoren-9-yl]-2-(1-phenyl-2-phenyliminoethenyl)phenyl]methanol
CID 118642783
2,2-bis[2-methoxy-5-(2-phenylpropan-2-yl)phenyl]-N-phenylethenimine
CID 118642792
4-(3,4-diphenoxyphenoxy)benzene-1,2-dicarbonitrile
CID 15667750
4,5-diphenoxybenzene-1,2-dicarbonitrile
CID 680327
methyl 2-methoxy-5-phenoxybenzoate
CID 82552164
(2-phenoxyphenyl)-phenylmethanone
CID 10802273
1,3,5-tris[4-(4-phenoxyphenoxy)phenoxy]benzene
CID 167430627

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine?
The IUPAC name of 2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine (CID 118642834) is 2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine.
What is the SMILES notation for 2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine?
The canonical SMILES for 2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine is C(=Nc1ccccc1)=C(c1ccccc1)c1cc(Oc2ccccc2)ccc1Oc1ccccc1.
What is the InChIKey of 2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine?
The InChIKey is FOYMDRCLYKPPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H23NO2/c1-5-13-25(14-6-1)31(24-33-26-15-7-2-8-16-26)30-23-29(34-27-17-9-3-10-18-27)21-22-32(30)35-28-19-11-4-12-20-28/h1-23H.
What are the key properties of 2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine?
2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine has a molecular weight of 453.54 g/mol, XLogP of 8.70, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-diphenoxyphenyl)-N,2-diphenylethenimine is sourced from PubChem (CID 118642834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).