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

C15H15BrClFN2 — CID 105290439

IUPAC[2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine
SMILESCc1ccc(C(Cc2ccc(F)c(Br)c2)NN)cc1Cl
InChIInChI=1S/C15H15BrClFN2/c1-9-2-4-11(8-13(9)17)15(20-19)7-10-3-5-14(18)12(16)6-10/h2-6,8,15,20H,7,19H2,1H3
InChIKeyHZKMTWXOVNTUMJ-UHFFFAOYSA-N
MW357.65 g/mol
LogP4.30
Rot. Bonds4

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

[2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine (PubChem CID 105290439) has the molecular formula C15H15BrClFN2 and a molecular weight of 357.65 g/mol. Its IUPAC name is [2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine
PubChem CID105290439
Molecular FormulaC15H15BrClFN2
Molecular Weight357.65 g/mol
Exact Mass356.01
IUPAC Name[2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine
SMILESCc1ccc(C(Cc2ccc(F)c(Br)c2)NN)cc1Cl
InChIInChI=1S/C15H15BrClFN2/c1-9-2-4-11(8-13(9)17)15(20-19)7-10-3-5-14(18)12(16)6-10/h2-6,8,15,20H,7,19H2,1H3
InChIKeyHZKMTWXOVNTUMJ-UHFFFAOYSA-N
XLogP4.30
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.65
LogP ≤ 54.30
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 [2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine?
The IUPAC name of [2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine (CID 105290439) is [2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine is Cc1ccc(C(Cc2ccc(F)c(Br)c2)NN)cc1Cl.
What is the InChIKey of [2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine?
The InChIKey is HZKMTWXOVNTUMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrClFN2/c1-9-2-4-11(8-13(9)17)15(20-19)7-10-3-5-14(18)12(16)6-10/h2-6,8,15,20H,7,19H2,1H3.
What are the key properties of [2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine?
[2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine has a molecular weight of 357.65 g/mol, XLogP of 4.30, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105290439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).