1-(4-bromophenyl)-N-(4-methylphenyl)methanimine

C14H12BrN — CID 525663

IUPAC1-(4-bromophenyl)-N-(4-methylphenyl)methanimine
SMILESCc1ccc(/N=C/c2ccc(Br)cc2)cc1
InChIInChI=1S/C14H12BrN/c1-11-2-8-14(9-3-11)16-10-12-4-6-13(15)7-5-12/h2-10H,1H3/b16-10+
InChIKeyJDEZSMCWSDUUAM-MHWRWJLKSA-N
MW274.16 g/mol
LogP4.51
Rot. Bonds2

About 1-(4-bromophenyl)-N-(4-methylphenyl)methanimine

1-(4-bromophenyl)-N-(4-methylphenyl)methanimine (PubChem CID 525663) has the molecular formula C14H12BrN and a molecular weight of 274.16 g/mol. Its IUPAC name is 1-(4-bromophenyl)-N-(4-methylphenyl)methanimine.

Molecular Properties

Compound Name1-(4-bromophenyl)-N-(4-methylphenyl)methanimine
PubChem CID525663
Molecular FormulaC14H12BrN
Molecular Weight274.16 g/mol
Exact Mass273.02
IUPAC Name1-(4-bromophenyl)-N-(4-methylphenyl)methanimine
SMILESCc1ccc(/N=C/c2ccc(Br)cc2)cc1
InChIInChI=1S/C14H12BrN/c1-11-2-8-14(9-3-11)16-10-12-4-6-13(15)7-5-12/h2-10H,1H3/b16-10+
InChIKeyJDEZSMCWSDUUAM-MHWRWJLKSA-N
XLogP4.51
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.16
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 1-(4-bromophenyl)-N-(4-methylphenyl)methanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-bromophenyl)-N-(4-methylphenyl)methanimine?
The IUPAC name of 1-(4-bromophenyl)-N-(4-methylphenyl)methanimine (CID 525663) is 1-(4-bromophenyl)-N-(4-methylphenyl)methanimine.
What is the SMILES notation for 1-(4-bromophenyl)-N-(4-methylphenyl)methanimine?
The canonical SMILES for 1-(4-bromophenyl)-N-(4-methylphenyl)methanimine is Cc1ccc(/N=C/c2ccc(Br)cc2)cc1.
What is the InChIKey of 1-(4-bromophenyl)-N-(4-methylphenyl)methanimine?
The InChIKey is JDEZSMCWSDUUAM-MHWRWJLKSA-N. The full InChI is InChI=1S/C14H12BrN/c1-11-2-8-14(9-3-11)16-10-12-4-6-13(15)7-5-12/h2-10H,1H3/b16-10+.
What are the key properties of 1-(4-bromophenyl)-N-(4-methylphenyl)methanimine?
1-(4-bromophenyl)-N-(4-methylphenyl)methanimine has a molecular weight of 274.16 g/mol, XLogP of 4.51, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-bromophenyl)-N-(4-methylphenyl)methanimine is sourced from PubChem (CID 525663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).