[1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine

C16H18BrFN2 — CID 105264141

IUPAC[1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
SMILESCc1cccc(C)c1CC(NN)c1ccc(F)c(Br)c1
InChIInChI=1S/C16H18BrFN2/c1-10-4-3-5-11(2)13(10)9-16(20-19)12-6-7-15(18)14(17)8-12/h3-8,16,20H,9,19H2,1-2H3
InChIKeyFUPKQOUBUGTNPM-UHFFFAOYSA-N
MW337.24 g/mol
LogP3.95
Rot. Bonds4

About [1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine

[1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine (PubChem CID 105264141) has the molecular formula C16H18BrFN2 and a molecular weight of 337.24 g/mol. Its IUPAC name is [1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
PubChem CID105264141
Molecular FormulaC16H18BrFN2
Molecular Weight337.24 g/mol
Exact Mass336.06
IUPAC Name[1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
SMILESCc1cccc(C)c1CC(NN)c1ccc(F)c(Br)c1
InChIInChI=1S/C16H18BrFN2/c1-10-4-3-5-11(2)13(10)9-16(20-19)12-6-7-15(18)14(17)8-12/h3-8,16,20H,9,19H2,1-2H3
InChIKeyFUPKQOUBUGTNPM-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-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105264214
[1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
CID 105218179
[1-(3-bromo-4-methoxyphenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
CID 105329211
[2-(2,6-difluorophenyl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105204208
[1-(3-bromo-4-fluorophenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105264219
[2-(3-bromo-4-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine
CID 105290439
[1-(2,4-difluoro-5-methylphenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
CID 105329197
[2-(3-bromo-2,6-difluorophenyl)-1-(3-fluorophenyl)ethyl]hydrazine
CID 106270697
[2-(3-bromo-4-fluorophenyl)-1-(3-fluorophenyl)ethyl]hydrazine
CID 105192894
[1-(4-bromo-3-chlorophenyl)-2-(2,6-difluorophenyl)ethyl]hydrazine
CID 105342880
[2-(2,6-dimethylphenyl)-1-(4-ethylphenyl)ethyl]hydrazine
CID 105197416
[2-(3-bromo-4-fluorophenyl)-1-(3-chlorophenyl)ethyl]hydrazine
CID 105194523

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine (CID 105264141) is [1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine is Cc1cccc(C)c1CC(NN)c1ccc(F)c(Br)c1.
What is the InChIKey of [1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine?
The InChIKey is FUPKQOUBUGTNPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18BrFN2/c1-10-4-3-5-11(2)13(10)9-16(20-19)12-6-7-15(18)14(17)8-12/h3-8,16,20H,9,19H2,1-2H3.
What are the key properties of [1-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine?
[1-(3-bromo-4-fluorophenyl)-2-(2,6-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-(3-bromo-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105264141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).