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

C15H13Cl2N — CID 831110

IUPAC1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine
SMILESCc1ccc(/N=C/c2ccc(Cl)cc2Cl)c(C)c1
InChIInChI=1S/C15H13Cl2N/c1-10-3-6-15(11(2)7-10)18-9-12-4-5-13(16)8-14(12)17/h3-9H,1-2H3/b18-9+
InChIKeyGTVSQNFTTXQTCJ-GIJQJNRQSA-N
MW278.18 g/mol
LogP5.36
Rot. Bonds2

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

1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine (PubChem CID 831110) has the molecular formula C15H13Cl2N and a molecular weight of 278.18 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine
PubChem CID831110
Molecular FormulaC15H13Cl2N
Molecular Weight278.18 g/mol
Exact Mass277.04
IUPAC Name1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine
SMILESCc1ccc(/N=C/c2ccc(Cl)cc2Cl)c(C)c1
InChIInChI=1S/C15H13Cl2N/c1-10-3-6-15(11(2)7-10)18-9-12-4-5-13(16)8-14(12)17/h3-9H,1-2H3/b18-9+
InChIKeyGTVSQNFTTXQTCJ-GIJQJNRQSA-N
XLogP5.36
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.18
LogP ≤ 55.36
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-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine?
The IUPAC name of 1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine (CID 831110) is 1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine.
What is the SMILES notation for 1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine?
The canonical SMILES for 1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine is Cc1ccc(/N=C/c2ccc(Cl)cc2Cl)c(C)c1.
What is the InChIKey of 1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine?
The InChIKey is GTVSQNFTTXQTCJ-GIJQJNRQSA-N. The full InChI is InChI=1S/C15H13Cl2N/c1-10-3-6-15(11(2)7-10)18-9-12-4-5-13(16)8-14(12)17/h3-9H,1-2H3/b18-9+.
What are the key properties of 1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine?
1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine has a molecular weight of 278.18 g/mol, XLogP of 5.36, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)-N-(2,4-dimethylphenyl)methanimine is sourced from PubChem (CID 831110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).