1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine

C16H17N — CID 614016

IUPAC1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine
SMILESCc1ccc(/N=C/c2ccc(C)cc2C)cc1
InChIInChI=1S/C16H17N/c1-12-5-8-16(9-6-12)17-11-15-7-4-13(2)10-14(15)3/h4-11H,1-3H3/b17-11+
InChIKeyOXXCWSWSHDCZFN-GZTJUZNOSA-N
MW223.32 g/mol
LogP4.36
Rot. Bonds2

About 1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine

1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine (PubChem CID 614016) has the molecular formula C16H17N and a molecular weight of 223.32 g/mol. Its IUPAC name is 1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine.

Molecular Properties

Compound Name1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine
PubChem CID614016
Molecular FormulaC16H17N
Molecular Weight223.32 g/mol
Exact Mass223.14
IUPAC Name1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine
SMILESCc1ccc(/N=C/c2ccc(C)cc2C)cc1
InChIInChI=1S/C16H17N/c1-12-5-8-16(9-6-12)17-11-15-7-4-13(2)10-14(15)3/h4-11H,1-3H3/b17-11+
InChIKeyOXXCWSWSHDCZFN-GZTJUZNOSA-N
XLogP4.36
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 54.36
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-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine?
The IUPAC name of 1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine (CID 614016) is 1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine.
What is the SMILES notation for 1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine?
The canonical SMILES for 1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine is Cc1ccc(/N=C/c2ccc(C)cc2C)cc1.
What is the InChIKey of 1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine?
The InChIKey is OXXCWSWSHDCZFN-GZTJUZNOSA-N. The full InChI is InChI=1S/C16H17N/c1-12-5-8-16(9-6-12)17-11-15-7-4-13(2)10-14(15)3/h4-11H,1-3H3/b17-11+.
What are the key properties of 1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine?
1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine has a molecular weight of 223.32 g/mol, XLogP of 4.36, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylphenyl)-N-(4-methylphenyl)methanimine is sourced from PubChem (CID 614016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).