1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine

C18H20N2 — CID 11414406

IUPAC1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine
SMILESC/C(=N\CC/N=C(\C)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20N2/c1-15(17-9-5-3-6-10-17)19-13-14-20-16(2)18-11-7-4-8-12-18/h3-12H,13-14H2,1-2H3/b19-15+,20-16+
InChIKeyCJZHJLMNWUXAAA-MXWIWYRXSA-N
MW264.37 g/mol
LogP4.00
Rot. Bonds5

About 1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine

1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine (PubChem CID 11414406) has the molecular formula C18H20N2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine.

Molecular Properties

Compound Name1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine
PubChem CID11414406
Molecular FormulaC18H20N2
Molecular Weight264.37 g/mol
Exact Mass264.16
IUPAC Name1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine
SMILESC/C(=N\CC/N=C(\C)c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20N2/c1-15(17-9-5-3-6-10-17)19-13-14-20-16(2)18-11-7-4-8-12-18/h3-12H,13-14H2,1-2H3/b19-15+,20-16+
InChIKeyCJZHJLMNWUXAAA-MXWIWYRXSA-N
XLogP4.00
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine?
The IUPAC name of 1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine (CID 11414406) is 1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine.
What is the SMILES notation for 1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine?
The canonical SMILES for 1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine is C/C(=N\CC/N=C(\C)c1ccccc1)c1ccccc1.
What is the InChIKey of 1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine?
The InChIKey is CJZHJLMNWUXAAA-MXWIWYRXSA-N. The full InChI is InChI=1S/C18H20N2/c1-15(17-9-5-3-6-10-17)19-13-14-20-16(2)18-11-7-4-8-12-18/h3-12H,13-14H2,1-2H3/b19-15+,20-16+.
What are the key properties of 1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine?
1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine has a molecular weight of 264.37 g/mol, XLogP of 4.00, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-[2-(1-phenylethylideneamino)ethyl]ethanimine is sourced from PubChem (CID 11414406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).