1,1-diphenyl-N-(1-phenylethyl)methanimine

C21H19N — CID 11108891

IUPAC1,1-diphenyl-N-(1-phenylethyl)methanimine
SMILESCC(N=C(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H19N/c1-17(18-11-5-2-6-12-18)22-21(19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-17H,1H3
InChIKeyXHVFYBJRJLFEPJ-UHFFFAOYSA-N
MW285.39 g/mol
LogP5.29
Rot. Bonds4

About 1,1-diphenyl-N-(1-phenylethyl)methanimine

1,1-diphenyl-N-(1-phenylethyl)methanimine (PubChem CID 11108891) has the molecular formula C21H19N and a molecular weight of 285.39 g/mol. Its IUPAC name is 1,1-diphenyl-N-(1-phenylethyl)methanimine.

Molecular Properties

Compound Name1,1-diphenyl-N-(1-phenylethyl)methanimine
PubChem CID11108891
Molecular FormulaC21H19N
Molecular Weight285.39 g/mol
Exact Mass285.15
IUPAC Name1,1-diphenyl-N-(1-phenylethyl)methanimine
SMILESCC(N=C(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H19N/c1-17(18-11-5-2-6-12-18)22-21(19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-17H,1H3
InChIKeyXHVFYBJRJLFEPJ-UHFFFAOYSA-N
XLogP5.29
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.39
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1,1-diphenyl-N-(1-phenylethyl)methanimine?
The IUPAC name of 1,1-diphenyl-N-(1-phenylethyl)methanimine (CID 11108891) is 1,1-diphenyl-N-(1-phenylethyl)methanimine.
What is the SMILES notation for 1,1-diphenyl-N-(1-phenylethyl)methanimine?
The canonical SMILES for 1,1-diphenyl-N-(1-phenylethyl)methanimine is CC(N=C(c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of 1,1-diphenyl-N-(1-phenylethyl)methanimine?
The InChIKey is XHVFYBJRJLFEPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N/c1-17(18-11-5-2-6-12-18)22-21(19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-17H,1H3.
What are the key properties of 1,1-diphenyl-N-(1-phenylethyl)methanimine?
1,1-diphenyl-N-(1-phenylethyl)methanimine has a molecular weight of 285.39 g/mol, XLogP of 5.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-diphenyl-N-(1-phenylethyl)methanimine is sourced from PubChem (CID 11108891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).