(E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine

C20H18NOP — CID 14703993

IUPAC(E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine
SMILESO=P(C/N=C/c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H18NOP/c22-23(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-21-16-18-10-4-1-5-11-18/h1-16H,17H2/b21-16+
InChIKeyMSUDOIHDNXKXIN-LTGZKZEYSA-N
MW319.34 g/mol
LogP4.08
Rot. Bonds5

About (E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine

(E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine (PubChem CID 14703993) has the molecular formula C20H18NOP and a molecular weight of 319.34 g/mol. Its IUPAC name is (E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine.

Molecular Properties

Compound Name(E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine
PubChem CID14703993
Molecular FormulaC20H18NOP
Molecular Weight319.34 g/mol
Exact Mass319.11
IUPAC Name(E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine
SMILESO=P(C/N=C/c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H18NOP/c22-23(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-21-16-18-10-4-1-5-11-18/h1-16H,17H2/b21-16+
InChIKeyMSUDOIHDNXKXIN-LTGZKZEYSA-N
XLogP4.08
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.34
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,2-Ethanediamine, N1,N2-bis(phenylmethylene)-
CID 66033
P,P-Diphenyl-N-(phenylmethylene)phosphinic amide
CID 608413
(NE)-N-((2-(diphenylphosphanyl)phenyl)methylidene)cyclohexanamine
CID 11280187
2-(Diphenylphosphino)benzaldehyde oxime
CID 15655459
N-{[2-(Diphenylphosphanyl)phenyl]methylidene}hydroxylamine
CID 71317484
(E,E)-N,N'-(Hexane-1,6-diyl)bis(1-phenylmethanimine)
CID 12573490
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

Frequently Asked Questions

What is the IUPAC name of (E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine?
The IUPAC name of (E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine (CID 14703993) is (E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine.
What is the SMILES notation for (E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine?
The canonical SMILES for (E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine is O=P(C/N=C/c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine?
The InChIKey is MSUDOIHDNXKXIN-LTGZKZEYSA-N. The full InChI is InChI=1S/C20H18NOP/c22-23(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-21-16-18-10-4-1-5-11-18/h1-16H,17H2/b21-16+.
What are the key properties of (E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine?
(E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine has a molecular weight of 319.34 g/mol, XLogP of 4.08, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(diphenylphosphorylmethyl)-1-phenylmethanimine is sourced from PubChem (CID 14703993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).