1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine

C16H15N — CID 145489460

IUPAC1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine
SMILESC=Cc1ccccc1/C=N/c1ccccc1C
InChIInChI=1S/C16H15N/c1-3-14-9-5-6-10-15(14)12-17-16-11-7-4-8-13(16)2/h3-12H,1H2,2H3/b17-12+
InChIKeyBXRDQHKJEGJVOP-SFQUDFHCSA-N
MW221.30 g/mol
LogP4.39
Rot. Bonds3

About 1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine

1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine (PubChem CID 145489460) has the molecular formula C16H15N and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine.

Molecular Properties

Compound Name1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine
PubChem CID145489460
Molecular FormulaC16H15N
Molecular Weight221.30 g/mol
Exact Mass221.12
IUPAC Name1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine
SMILESC=Cc1ccccc1/C=N/c1ccccc1C
InChIInChI=1S/C16H15N/c1-3-14-9-5-6-10-15(14)12-17-16-11-7-4-8-13(16)2/h3-12H,1H2,2H3/b17-12+
InChIKeyBXRDQHKJEGJVOP-SFQUDFHCSA-N
XLogP4.39
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 54.39
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-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine?
The IUPAC name of 1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine (CID 145489460) is 1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine.
What is the SMILES notation for 1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine?
The canonical SMILES for 1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine is C=Cc1ccccc1/C=N/c1ccccc1C.
What is the InChIKey of 1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine?
The InChIKey is BXRDQHKJEGJVOP-SFQUDFHCSA-N. The full InChI is InChI=1S/C16H15N/c1-3-14-9-5-6-10-15(14)12-17-16-11-7-4-8-13(16)2/h3-12H,1H2,2H3/b17-12+.
What are the key properties of 1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine?
1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine has a molecular weight of 221.30 g/mol, XLogP of 4.39, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethenylphenyl)-N-(2-methylphenyl)methanimine is sourced from PubChem (CID 145489460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).