1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine

C15H16N2 — CID 14685415

IUPAC1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine
SMILESC/C(=N\NCc1ccccc1)c1ccccc1
InChIInChI=1S/C15H16N2/c1-13(15-10-6-3-7-11-15)17-16-12-14-8-4-2-5-9-14/h2-11,16H,12H2,1H3/b17-13+
InChIKeyNYRZIPBXQDHENU-GHRIWEEISA-N
MW224.31 g/mol
LogP3.20
Rot. Bonds4

About 1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine

1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine (PubChem CID 14685415) has the molecular formula C15H16N2 and a molecular weight of 224.31 g/mol. Its IUPAC name is 1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine.

Molecular Properties

Compound Name1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine
PubChem CID14685415
Molecular FormulaC15H16N2
Molecular Weight224.31 g/mol
Exact Mass224.13
IUPAC Name1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine
SMILESC/C(=N\NCc1ccccc1)c1ccccc1
InChIInChI=1S/C15H16N2/c1-13(15-10-6-3-7-11-15)17-16-12-14-8-4-2-5-9-14/h2-11,16H,12H2,1H3/b17-13+
InChIKeyNYRZIPBXQDHENU-GHRIWEEISA-N
XLogP3.20
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine?
The IUPAC name of 1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine (CID 14685415) is 1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine.
What is the SMILES notation for 1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine?
The canonical SMILES for 1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine is C/C(=N\NCc1ccccc1)c1ccccc1.
What is the InChIKey of 1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine?
The InChIKey is NYRZIPBXQDHENU-GHRIWEEISA-N. The full InChI is InChI=1S/C15H16N2/c1-13(15-10-6-3-7-11-15)17-16-12-14-8-4-2-5-9-14/h2-11,16H,12H2,1H3/b17-13+.
What are the key properties of 1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine?
1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine has a molecular weight of 224.31 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-[(E)-1-phenylethylideneamino]methanamine is sourced from PubChem (CID 14685415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).