N-(2-bromophenyl)-1-phenylmethanimine

C13H10BrN — CID 641193

IUPACN-(2-bromophenyl)-1-phenylmethanimine
SMILESBrc1ccccc1/N=C/c1ccccc1
InChIInChI=1S/C13H10BrN/c14-12-8-4-5-9-13(12)15-10-11-6-2-1-3-7-11/h1-10H/b15-10+
InChIKeyJNKVUJIBXQCQBK-XNTDXEJSSA-N
MW260.13 g/mol
LogP4.20
Rot. Bonds2

About N-(2-bromophenyl)-1-phenylmethanimine

N-(2-bromophenyl)-1-phenylmethanimine (PubChem CID 641193) has the molecular formula C13H10BrN and a molecular weight of 260.13 g/mol. Its IUPAC name is N-(2-bromophenyl)-1-phenylmethanimine.

Molecular Properties

Compound NameN-(2-bromophenyl)-1-phenylmethanimine
PubChem CID641193
Molecular FormulaC13H10BrN
Molecular Weight260.13 g/mol
Exact Mass259.00
IUPAC NameN-(2-bromophenyl)-1-phenylmethanimine
SMILESBrc1ccccc1/N=C/c1ccccc1
InChIInChI=1S/C13H10BrN/c14-12-8-4-5-9-13(12)15-10-11-6-2-1-3-7-11/h1-10H/b15-10+
InChIKeyJNKVUJIBXQCQBK-XNTDXEJSSA-N
XLogP4.20
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.13
LogP ≤ 54.20
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 N-(2-bromophenyl)-1-phenylmethanimine?
The IUPAC name of N-(2-bromophenyl)-1-phenylmethanimine (CID 641193) is N-(2-bromophenyl)-1-phenylmethanimine.
What is the SMILES notation for N-(2-bromophenyl)-1-phenylmethanimine?
The canonical SMILES for N-(2-bromophenyl)-1-phenylmethanimine is Brc1ccccc1/N=C/c1ccccc1.
What is the InChIKey of N-(2-bromophenyl)-1-phenylmethanimine?
The InChIKey is JNKVUJIBXQCQBK-XNTDXEJSSA-N. The full InChI is InChI=1S/C13H10BrN/c14-12-8-4-5-9-13(12)15-10-11-6-2-1-3-7-11/h1-10H/b15-10+.
What are the key properties of N-(2-bromophenyl)-1-phenylmethanimine?
N-(2-bromophenyl)-1-phenylmethanimine has a molecular weight of 260.13 g/mol, XLogP of 4.20, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-1-phenylmethanimine is sourced from PubChem (CID 641193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).