[1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine

C15H15BrClFN2 — CID 106868426

IUPAC[1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine
SMILESCc1ccc(CC(NN)c2c(F)cccc2Br)c(Cl)c1
InChIInChI=1S/C15H15BrClFN2/c1-9-5-6-10(12(17)7-9)8-14(20-19)15-11(16)3-2-4-13(15)18/h2-7,14,20H,8,19H2,1H3
InChIKeyRZAGQBKUIOSYQI-UHFFFAOYSA-N
MW357.65 g/mol
LogP4.30
Rot. Bonds4

About [1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine

[1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine (PubChem CID 106868426) has the molecular formula C15H15BrClFN2 and a molecular weight of 357.65 g/mol. Its IUPAC name is [1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine
PubChem CID106868426
Molecular FormulaC15H15BrClFN2
Molecular Weight357.65 g/mol
Exact Mass356.01
IUPAC Name[1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine
SMILESCc1ccc(CC(NN)c2c(F)cccc2Br)c(Cl)c1
InChIInChI=1S/C15H15BrClFN2/c1-9-5-6-10(12(17)7-9)8-14(20-19)15-11(16)3-2-4-13(15)18/h2-7,14,20H,8,19H2,1H3
InChIKeyRZAGQBKUIOSYQI-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 [1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine (CID 106868426) is [1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine is Cc1ccc(CC(NN)c2c(F)cccc2Br)c(Cl)c1.
What is the InChIKey of [1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine?
The InChIKey is RZAGQBKUIOSYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrClFN2/c1-9-5-6-10(12(17)7-9)8-14(20-19)15-11(16)3-2-4-13(15)18/h2-7,14,20H,8,19H2,1H3.
What are the key properties of [1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine?
[1-(2-bromo-6-fluorophenyl)-2-(2-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 [1-(2-bromo-6-fluorophenyl)-2-(2-chloro-4-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 106868426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).