[1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine

C16H18BrFN2 — CID 105280879

IUPAC[1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)cc(CC(NN)c2ccc(Br)cc2F)c1
InChIInChI=1S/C16H18BrFN2/c1-10-5-11(2)7-12(6-10)8-16(20-19)14-4-3-13(17)9-15(14)18/h3-7,9,16,20H,8,19H2,1-2H3
InChIKeyZUAASHHCNTVBDH-UHFFFAOYSA-N
MW337.24 g/mol
LogP3.95
Rot. Bonds4

About [1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine

[1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine (PubChem CID 105280879) has the molecular formula C16H18BrFN2 and a molecular weight of 337.24 g/mol. Its IUPAC name is [1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
PubChem CID105280879
Molecular FormulaC16H18BrFN2
Molecular Weight337.24 g/mol
Exact Mass336.06
IUPAC Name[1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)cc(CC(NN)c2ccc(Br)cc2F)c1
InChIInChI=1S/C16H18BrFN2/c1-10-5-11(2)7-12(6-10)8-16(20-19)14-4-3-13(17)9-15(14)18/h3-7,9,16,20H,8,19H2,1-2H3
InChIKeyZUAASHHCNTVBDH-UHFFFAOYSA-N
XLogP3.95
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.24
LogP ≤ 53.95
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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Related Compounds

[1-(4-bromo-2-fluorophenyl)-2-pyridin-4-ylethyl]hydrazine
CID 105281009
[2-(3-bromo-5-fluorophenyl)-1-(2-fluoro-4-methylphenyl)ethyl]hydrazine
CID 105324778
[1-(4-bromo-2-fluorophenyl)-2-(5-bromo-2-fluorophenyl)ethyl]hydrazine
CID 105280917
1-(4-bromo-2-fluorophenyl)-N-methyl-2-(4-methylphenyl)ethanamine
CID 61064541
[1-(2-bromo-5-chlorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 114027312
[1-(4-bromo-2-fluorophenyl)-2-(2-bromophenyl)ethyl]hydrazine
CID 105281068
[2-(2-bromo-5-fluorophenyl)-1-(4-bromo-2-fluorophenyl)ethyl]hydrazine
CID 105280999
[1-(4-bromo-2-fluorophenyl)-2-(5-ethyl-2-pyridinyl)ethyl]hydrazine
CID 105280856
[1-(3,5-dibromophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 107978906
[1-(4-bromo-2-fluorophenyl)-2-(2-methoxyphenyl)ethyl]hydrazine
CID 105281069
[1-(3,4-difluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 105197059
[2-(4-bromo-2-fluorophenyl)-1-(5-bromo-2-methylphenyl)ethyl]hydrazine
CID 105297391

Frequently Asked Questions

What is the IUPAC name of [1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine (CID 105280879) is [1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine is Cc1cc(C)cc(CC(NN)c2ccc(Br)cc2F)c1.
What is the InChIKey of [1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
The InChIKey is ZUAASHHCNTVBDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18BrFN2/c1-10-5-11(2)7-12(6-10)8-16(20-19)14-4-3-13(17)9-15(14)18/h3-7,9,16,20H,8,19H2,1-2H3.
What are the key properties of [1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine?
[1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine has a molecular weight of 337.24 g/mol, XLogP of 3.95, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromo-2-fluorophenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105280879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).