1-(2,4-dimethylphenyl)-N-phenylmethanimine

C15H15N — CID 13476227

IUPAC1-(2,4-dimethylphenyl)-N-phenylmethanimine
SMILESCc1ccc(/C=N/c2ccccc2)c(C)c1
InChIInChI=1S/C15H15N/c1-12-8-9-14(13(2)10-12)11-16-15-6-4-3-5-7-15/h3-11H,1-2H3/b16-11+
InChIKeyQMOJTDZIUPBGHI-LFIBNONCSA-N
MW209.29 g/mol
LogP4.05
Rot. Bonds2

About 1-(2,4-dimethylphenyl)-N-phenylmethanimine

1-(2,4-dimethylphenyl)-N-phenylmethanimine (PubChem CID 13476227) has the molecular formula C15H15N and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-(2,4-dimethylphenyl)-N-phenylmethanimine.

Molecular Properties

Compound Name1-(2,4-dimethylphenyl)-N-phenylmethanimine
PubChem CID13476227
Molecular FormulaC15H15N
Molecular Weight209.29 g/mol
Exact Mass209.12
IUPAC Name1-(2,4-dimethylphenyl)-N-phenylmethanimine
SMILESCc1ccc(/C=N/c2ccccc2)c(C)c1
InChIInChI=1S/C15H15N/c1-12-8-9-14(13(2)10-12)11-16-15-6-4-3-5-7-15/h3-11H,1-2H3/b16-11+
InChIKeyQMOJTDZIUPBGHI-LFIBNONCSA-N
XLogP4.05
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 54.05
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-phenylmethanimine?
The IUPAC name of 1-(2,4-dimethylphenyl)-N-phenylmethanimine (CID 13476227) is 1-(2,4-dimethylphenyl)-N-phenylmethanimine.
What is the SMILES notation for 1-(2,4-dimethylphenyl)-N-phenylmethanimine?
The canonical SMILES for 1-(2,4-dimethylphenyl)-N-phenylmethanimine is Cc1ccc(/C=N/c2ccccc2)c(C)c1.
What is the InChIKey of 1-(2,4-dimethylphenyl)-N-phenylmethanimine?
The InChIKey is QMOJTDZIUPBGHI-LFIBNONCSA-N. The full InChI is InChI=1S/C15H15N/c1-12-8-9-14(13(2)10-12)11-16-15-6-4-3-5-7-15/h3-11H,1-2H3/b16-11+.
What are the key properties of 1-(2,4-dimethylphenyl)-N-phenylmethanimine?
1-(2,4-dimethylphenyl)-N-phenylmethanimine has a molecular weight of 209.29 g/mol, XLogP of 4.05, 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-phenylmethanimine is sourced from PubChem (CID 13476227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).