(E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine

C19H15FNOP — CID 52952440

IUPAC(E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine
SMILESO=P(/N=C/c1ccccc1F)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H15FNOP/c20-19-14-8-7-9-16(19)15-21-23(22,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15H/b21-15+
InChIKeyGACWDLGYFBMPQX-RCCKNPSSSA-N
MW323.31 g/mol
LogP4.17
Rot. Bonds4

About (E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine

(E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine (PubChem CID 52952440) has the molecular formula C19H15FNOP and a molecular weight of 323.31 g/mol. Its IUPAC name is (E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine.

Molecular Properties

Compound Name(E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine
PubChem CID52952440
Molecular FormulaC19H15FNOP
Molecular Weight323.31 g/mol
Exact Mass323.09
IUPAC Name(E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine
SMILESO=P(/N=C/c1ccccc1F)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H15FNOP/c20-19-14-8-7-9-16(19)15-21-23(22,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15H/b21-15+
InChIKeyGACWDLGYFBMPQX-RCCKNPSSSA-N
XLogP4.17
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.31
LogP ≤ 54.17
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'}

Analyze (E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine 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

P,P-Diphenyl-N-(phenylmethylene)phosphinic amide
CID 608413
2-(Diphenylphosphino)benzaldehyde oxime
CID 15655459
N-{[2-(Diphenylphosphanyl)phenyl]methylidene}hydroxylamine
CID 71317484
N-(diphenylphosphinyl)acetophenoneimine
CID 85073507
(E)-N-Benzylidene-P,P-diphenylphosphinic amide
CID 9603698
(E)-N-diphenylphosphoryl-1-phenylethanimine
CID 9944887
[Diazo(phenyl)methyl](oxo)diphenyl-lambda~5~-phosphane
CID 12615609
(E)-N-diphenylphosphoryl-1-phenylpropan-1-imine
CID 13736338
N-[2-(Diphenylphosphino)benzylidene]hydroxylamine
CID 98043674
1-(Diphenylphosphinoyl)-4,4,4-trifluoro-1-phenyl-2-azabut-1-ene
CID 4090491
(E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine
CID 11313306
(E)-N-diphenylphosphoryl-1-[4-(trifluoromethyl)phenyl]methanimine
CID 13431939

Frequently Asked Questions

What is the IUPAC name of (E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine?
The IUPAC name of (E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine (CID 52952440) is (E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine.
What is the SMILES notation for (E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine?
The canonical SMILES for (E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine is O=P(/N=C/c1ccccc1F)(c1ccccc1)c1ccccc1.
What is the InChIKey of (E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine?
The InChIKey is GACWDLGYFBMPQX-RCCKNPSSSA-N. The full InChI is InChI=1S/C19H15FNOP/c20-19-14-8-7-9-16(19)15-21-23(22,17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15H/b21-15+.
What are the key properties of (E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine?
(E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine has a molecular weight of 323.31 g/mol, XLogP of 4.17, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-diphenylphosphoryl-1-(2-fluorophenyl)methanimine is sourced from PubChem (CID 52952440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).