(E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine

C26H23N2P — CID 6291166

IUPAC(E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine
SMILESC/C(=N\N=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C26H23N2P/c1-22(23-14-6-2-7-15-23)27-28-29(24-16-8-3-9-17-24,25-18-10-4-11-19-25)26-20-12-5-13-21-26/h2-21H,1H3/b27-22+
InChIKeyVATKBSNZEQFZGR-HPNDGRJYSA-N
MW394.46 g/mol
LogP5.59
Rot. Bonds5

About (E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine

(E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine (PubChem CID 6291166) has the molecular formula C26H23N2P and a molecular weight of 394.46 g/mol. Its IUPAC name is (E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine.

Molecular Properties

Compound Name(E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine
PubChem CID6291166
Molecular FormulaC26H23N2P
Molecular Weight394.46 g/mol
Exact Mass394.16
IUPAC Name(E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine
SMILESC/C(=N\N=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C26H23N2P/c1-22(23-14-6-2-7-15-23)27-28-29(24-16-8-3-9-17-24,25-18-10-4-11-19-25)26-20-12-5-13-21-26/h2-21H,1H3/b27-22+
InChIKeyVATKBSNZEQFZGR-HPNDGRJYSA-N
XLogP5.59
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.46
LogP ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze (E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine?
The IUPAC name of (E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine (CID 6291166) is (E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine.
What is the SMILES notation for (E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine?
The canonical SMILES for (E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine is C/C(=N\N=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of (E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine?
The InChIKey is VATKBSNZEQFZGR-HPNDGRJYSA-N. The full InChI is InChI=1S/C26H23N2P/c1-22(23-14-6-2-7-15-23)27-28-29(24-16-8-3-9-17-24,25-18-10-4-11-19-25)26-20-12-5-13-21-26/h2-21H,1H3/b27-22+.
What are the key properties of (E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine?
(E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine has a molecular weight of 394.46 g/mol, XLogP of 5.59, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-phenyl-N-[(triphenyl-λ5-phosphanylidene)amino]ethanimine is sourced from PubChem (CID 6291166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).