(E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine

C19H15FNOP — CID 11313306

IUPAC(E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine
SMILESO=P(/N=C/c1ccc(F)cc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H15FNOP/c20-17-13-11-16(12-14-17)15-21-23(22,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-15H/b21-15+
InChIKeyTVOKLUREPCWSAB-RCCKNPSSSA-N
MW323.31 g/mol
LogP4.17
Rot. Bonds4

About (E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine

(E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine (PubChem CID 11313306) has the molecular formula C19H15FNOP and a molecular weight of 323.31 g/mol. Its IUPAC name is (E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine.

Molecular Properties

Compound Name(E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine
PubChem CID11313306
Molecular FormulaC19H15FNOP
Molecular Weight323.31 g/mol
Exact Mass323.09
IUPAC Name(E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine
SMILESO=P(/N=C/c1ccc(F)cc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H15FNOP/c20-17-13-11-16(12-14-17)15-21-23(22,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-15H/b21-15+
InChIKeyTVOKLUREPCWSAB-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'}

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Related Compounds

(E)-1-(1,3-benzodioxol-5-yl)-N-diphenylphosphorylmethanimine
CID 10915051
(E)-N-diphenylphosphoryl-1-naphthalen-1-ylmethanimine
CID 11382689
N-[(4-fluorophenyl)methylideneamino]benzamide
CID 724426
2-[(4-fluorophenyl)methylideneamino]aniline
CID 21236289
N-[(4-fluorophenyl)methylideneamino]-1,1-diphenylmethanimine
CID 4618251
(E)-N-diphenylphosphoryl-4-phenylbut-3-en-1-imine
CID 68513071
N-[(4-fluorophenyl)methylidene]benzamide
CID 10966224
N-(2-fluorophenyl)-1-(4-fluorophenyl)methanimine
CID 23329235
2-[(4-fluorophenyl)methylideneamino]benzamide
CID 932011
N-diphenylphosphorylcyclohepta-2,4,6-trien-1-imine
CID 15260741
(E)-N-diphenylphosphoryl-1-(2-prop-2-enylphenyl)methanimine
CID 177417010
N-[(E)-(4-fluorophenyl)methylideneamino]-2-phenylacetamide
CID 6899001

Frequently Asked Questions

What is the IUPAC name of (E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine?
The IUPAC name of (E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine (CID 11313306) is (E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine.
What is the SMILES notation for (E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine?
The canonical SMILES for (E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine is O=P(/N=C/c1ccc(F)cc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine?
The InChIKey is TVOKLUREPCWSAB-RCCKNPSSSA-N. The full InChI is InChI=1S/C19H15FNOP/c20-17-13-11-16(12-14-17)15-21-23(22,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-15H/b21-15+.
What are the key properties of (E)-N-diphenylphosphoryl-1-(4-fluorophenyl)methanimine?
(E)-N-diphenylphosphoryl-1-(4-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-(4-fluorophenyl)methanimine is sourced from PubChem (CID 11313306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).