N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine

C26H20NP — CID 11760607

IUPACN-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine
SMILESC(=C=P(c1ccccc1)(c1ccccc1)c1ccccc1)=Nc1ccccc1
InChIInChI=1S/C26H20NP/c1-5-13-23(14-6-1)27-21-22-28(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20H
InChIKeyJTIVZAHHRRRSRM-UHFFFAOYSA-N
MW377.43 g/mol
LogP4.94
Rot. Bonds4

About N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine

N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine (PubChem CID 11760607) has the molecular formula C26H20NP and a molecular weight of 377.43 g/mol. Its IUPAC name is N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine.

Molecular Properties

Compound NameN-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine
PubChem CID11760607
Molecular FormulaC26H20NP
Molecular Weight377.43 g/mol
Exact Mass377.13
IUPAC NameN-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine
SMILESC(=C=P(c1ccccc1)(c1ccccc1)c1ccccc1)=Nc1ccccc1
InChIInChI=1S/C26H20NP/c1-5-13-23(14-6-1)27-21-22-28(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20H
InChIKeyJTIVZAHHRRRSRM-UHFFFAOYSA-N
XLogP4.94
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.43
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine?
The IUPAC name of N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine (CID 11760607) is N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine.
What is the SMILES notation for N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine?
The canonical SMILES for N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine is C(=C=P(c1ccccc1)(c1ccccc1)c1ccccc1)=Nc1ccccc1.
What is the InChIKey of N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine?
The InChIKey is JTIVZAHHRRRSRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20NP/c1-5-13-23(14-6-1)27-21-22-28(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20H.
What are the key properties of N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine?
N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine has a molecular weight of 377.43 g/mol, XLogP of 4.94, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-2-(triphenyl-λ5-phosphanylidene)ethenimine is sourced from PubChem (CID 11760607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).