[1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine

C16H18Br2N2 — CID 107948068

IUPAC[1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine
SMILESCc1ccc(CC(NN)c2ccc(Br)cc2Br)cc1C
InChIInChI=1S/C16H18Br2N2/c1-10-3-4-12(7-11(10)2)8-16(20-19)14-6-5-13(17)9-15(14)18/h3-7,9,16,20H,8,19H2,1-2H3
InChIKeyJIIAKVIQXYTQQB-UHFFFAOYSA-N
MW398.14 g/mol
LogP4.58
Rot. Bonds4

About [1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine

[1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine (PubChem CID 107948068) has the molecular formula C16H18Br2N2 and a molecular weight of 398.14 g/mol. Its IUPAC name is [1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine
PubChem CID107948068
Molecular FormulaC16H18Br2N2
Molecular Weight398.14 g/mol
Exact Mass395.98
IUPAC Name[1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine
SMILESCc1ccc(CC(NN)c2ccc(Br)cc2Br)cc1C
InChIInChI=1S/C16H18Br2N2/c1-10-3-4-12(7-11(10)2)8-16(20-19)14-6-5-13(17)9-15(14)18/h3-7,9,16,20H,8,19H2,1-2H3
InChIKeyJIIAKVIQXYTQQB-UHFFFAOYSA-N
XLogP4.58
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.14
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine (CID 107948068) is [1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine is Cc1ccc(CC(NN)c2ccc(Br)cc2Br)cc1C.
What is the InChIKey of [1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine?
The InChIKey is JIIAKVIQXYTQQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18Br2N2/c1-10-3-4-12(7-11(10)2)8-16(20-19)14-6-5-13(17)9-15(14)18/h3-7,9,16,20H,8,19H2,1-2H3.
What are the key properties of [1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine?
[1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine has a molecular weight of 398.14 g/mol, XLogP of 4.58, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,4-dibromophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 107948068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).