1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine

C17H18N2O — CID 825839

IUPAC1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine
SMILESC(=N/c1ccccc1)\c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C17H18N2O/c1-2-4-16(5-3-1)18-14-15-6-8-17(9-7-15)19-10-12-20-13-11-19/h1-9,14H,10-13H2/b18-14+
InChIKeyPFBYGEGREFBQBL-NBVRZTHBSA-N
MW266.34 g/mol
LogP3.27
Rot. Bonds3

About 1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine

1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine (PubChem CID 825839) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine.

Molecular Properties

Compound Name1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine
PubChem CID825839
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine
SMILESC(=N/c1ccccc1)\c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C17H18N2O/c1-2-4-16(5-3-1)18-14-15-6-8-17(9-7-15)19-10-12-20-13-11-19/h1-9,14H,10-13H2/b18-14+
InChIKeyPFBYGEGREFBQBL-NBVRZTHBSA-N
XLogP3.27
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine?
The IUPAC name of 1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine (CID 825839) is 1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine.
What is the SMILES notation for 1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine?
The canonical SMILES for 1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine is C(=N/c1ccccc1)\c1ccc(N2CCOCC2)cc1.
What is the InChIKey of 1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine?
The InChIKey is PFBYGEGREFBQBL-NBVRZTHBSA-N. The full InChI is InChI=1S/C17H18N2O/c1-2-4-16(5-3-1)18-14-15-6-8-17(9-7-15)19-10-12-20-13-11-19/h1-9,14H,10-13H2/b18-14+.
What are the key properties of 1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine?
1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine has a molecular weight of 266.34 g/mol, XLogP of 3.27, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-morpholin-4-ylphenyl)-N-phenylmethanimine is sourced from PubChem (CID 825839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).