[1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine

C16H19BrN2 — CID 105285025

IUPAC[1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine
SMILESCc1cccc(CC(NN)c2ccc(C)cc2Br)c1
InChIInChI=1S/C16H19BrN2/c1-11-4-3-5-13(8-11)10-16(19-18)14-7-6-12(2)9-15(14)17/h3-9,16,19H,10,18H2,1-2H3
InChIKeyHIBOGZYOWVEFGU-UHFFFAOYSA-N
MW319.25 g/mol
LogP3.81
Rot. Bonds4

About [1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine

[1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine (PubChem CID 105285025) has the molecular formula C16H19BrN2 and a molecular weight of 319.25 g/mol. Its IUPAC name is [1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine
PubChem CID105285025
Molecular FormulaC16H19BrN2
Molecular Weight319.25 g/mol
Exact Mass318.07
IUPAC Name[1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine
SMILESCc1cccc(CC(NN)c2ccc(C)cc2Br)c1
InChIInChI=1S/C16H19BrN2/c1-11-4-3-5-13(8-11)10-16(19-18)14-7-6-12(2)9-15(14)17/h3-9,16,19H,10,18H2,1-2H3
InChIKeyHIBOGZYOWVEFGU-UHFFFAOYSA-N
XLogP3.81
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.25
LogP ≤ 53.81
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-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine (CID 105285025) is [1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine is Cc1cccc(CC(NN)c2ccc(C)cc2Br)c1.
What is the InChIKey of [1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine?
The InChIKey is HIBOGZYOWVEFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19BrN2/c1-11-4-3-5-13(8-11)10-16(19-18)14-7-6-12(2)9-15(14)17/h3-9,16,19H,10,18H2,1-2H3.
What are the key properties of [1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine?
[1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine has a molecular weight of 319.25 g/mol, XLogP of 3.81, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-4-methylphenyl)-2-(3-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105285025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).