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

C16H18BrFN2 — CID 105287879

IUPAC[1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine
SMILESCCc1ccc(CC(NN)c2cccc(F)c2Br)cc1
InChIInChI=1S/C16H18BrFN2/c1-2-11-6-8-12(9-7-11)10-15(20-19)13-4-3-5-14(18)16(13)17/h3-9,15,20H,2,10,19H2,1H3
InChIKeyXVCVNFPPCXXIAI-UHFFFAOYSA-N
MW337.24 g/mol
LogP3.90
Rot. Bonds5

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

[1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine (PubChem CID 105287879) has the molecular formula C16H18BrFN2 and a molecular weight of 337.24 g/mol. Its IUPAC name is [1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine
PubChem CID105287879
Molecular FormulaC16H18BrFN2
Molecular Weight337.24 g/mol
Exact Mass336.06
IUPAC Name[1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine
SMILESCCc1ccc(CC(NN)c2cccc(F)c2Br)cc1
InChIInChI=1S/C16H18BrFN2/c1-2-11-6-8-12(9-7-11)10-15(20-19)13-4-3-5-14(18)16(13)17/h3-9,15,20H,2,10,19H2,1H3
InChIKeyXVCVNFPPCXXIAI-UHFFFAOYSA-N
XLogP3.90
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.24
LogP ≤ 53.90
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-(2-bromo-3-fluorophenyl)-2-(3,4-difluorophenyl)ethyl]hydrazine
CID 105330355
1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethanamine
CID 115803766
[(2-bromo-3-fluorophenyl)-(4-ethylphenyl)methyl]hydrazine
CID 105292836
[1-(2-bromo-3-fluorophenyl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105340815
1-(2-bromo-3-fluorophenyl)undecylhydrazine
CID 105298339
[1-(2-bromo-3-methylphenyl)-2-(4-methylphenyl)ethyl]hydrazine
CID 107985933
[1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine
CID 105295484
[2-(2-bromo-3-fluorophenyl)-1-(2,3-dimethylphenyl)ethyl]hydrazine
CID 105327015
[2-(4-ethylphenyl)-1-(5-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105211491
[1-(2-bromo-3-fluorophenyl)-2-(2-propyl-1,2,4-triazol-3-yl)ethyl]hydrazine
CID 105319144
1-(2-bromo-6-fluorophenyl)-2-(4-ethylphenyl)ethanol
CID 114885678
[2-(2-bromo-3-fluorophenyl)-1-(2-ethoxyphenyl)ethyl]hydrazine
CID 105260715

Frequently Asked Questions

What is the IUPAC name of [1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine (CID 105287879) is [1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine is CCc1ccc(CC(NN)c2cccc(F)c2Br)cc1.
What is the InChIKey of [1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine?
The InChIKey is XVCVNFPPCXXIAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18BrFN2/c1-2-11-6-8-12(9-7-11)10-15(20-19)13-4-3-5-14(18)16(13)17/h3-9,15,20H,2,10,19H2,1H3.
What are the key properties of [1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine?
[1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine has a molecular weight of 337.24 g/mol, XLogP of 3.90, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105287879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).