1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine

C15H14ClN — CID 4054178

IUPAC1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine
SMILESCc1cc(C)cc(/N=C/c2ccc(Cl)cc2)c1
InChIInChI=1S/C15H14ClN/c1-11-7-12(2)9-15(8-11)17-10-13-3-5-14(16)6-4-13/h3-10H,1-2H3/b17-10+
InChIKeyRCFAHJMENQRFOE-LICLKQGHSA-N
MW243.74 g/mol
LogP4.71
Rot. Bonds2

About 1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine

1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine (PubChem CID 4054178) has the molecular formula C15H14ClN and a molecular weight of 243.74 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine
PubChem CID4054178
Molecular FormulaC15H14ClN
Molecular Weight243.74 g/mol
Exact Mass243.08
IUPAC Name1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine
SMILESCc1cc(C)cc(/N=C/c2ccc(Cl)cc2)c1
InChIInChI=1S/C15H14ClN/c1-11-7-12(2)9-15(8-11)17-10-13-3-5-14(16)6-4-13/h3-10H,1-2H3/b17-10+
InChIKeyRCFAHJMENQRFOE-LICLKQGHSA-N
XLogP4.71
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.74
LogP ≤ 54.71
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-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine?
The IUPAC name of 1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine (CID 4054178) is 1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine.
What is the SMILES notation for 1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine?
The canonical SMILES for 1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine is Cc1cc(C)cc(/N=C/c2ccc(Cl)cc2)c1.
What is the InChIKey of 1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine?
The InChIKey is RCFAHJMENQRFOE-LICLKQGHSA-N. The full InChI is InChI=1S/C15H14ClN/c1-11-7-12(2)9-15(8-11)17-10-13-3-5-14(16)6-4-13/h3-10H,1-2H3/b17-10+.
What are the key properties of 1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine?
1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine has a molecular weight of 243.74 g/mol, XLogP of 4.71, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-(3,5-dimethylphenyl)methanimine is sourced from PubChem (CID 4054178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).