[1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine

C12H12BrFN2S — CID 105295484

IUPAC[1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine
SMILESNNC(Cc1cccs1)c1cccc(F)c1Br
InChIInChI=1S/C12H12BrFN2S/c13-12-9(4-1-5-10(12)14)11(16-15)7-8-3-2-6-17-8/h1-6,11,16H,7,15H2
InChIKeyFSQCHTWXAQTJKV-UHFFFAOYSA-N
MW315.21 g/mol
LogP3.40
Rot. Bonds4

About [1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine

[1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine (PubChem CID 105295484) has the molecular formula C12H12BrFN2S and a molecular weight of 315.21 g/mol. Its IUPAC name is [1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine
PubChem CID105295484
Molecular FormulaC12H12BrFN2S
Molecular Weight315.21 g/mol
Exact Mass313.99
IUPAC Name[1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine
SMILESNNC(Cc1cccs1)c1cccc(F)c1Br
InChIInChI=1S/C12H12BrFN2S/c13-12-9(4-1-5-10(12)14)11(16-15)7-8-3-2-6-17-8/h1-6,11,16H,7,15H2
InChIKeyFSQCHTWXAQTJKV-UHFFFAOYSA-N
XLogP3.40
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.21
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(2,3-dimethylphenyl)-2-thiophen-2-ylethyl]hydrazine
CID 105211766
2-(1-hydrazinyl-2-thiophen-2-ylethyl)aniline
CID 105223953
[1-(2-fluoro-5-methylphenyl)-2-thiophen-2-ylethyl]hydrazine
CID 105211767
1-(2-bromo-3-fluorophenyl)-3-thiophen-2-ylpropan-1-ol
CID 115800366
[1-(2-bromo-3-fluorophenyl)-2-(3,4-difluorophenyl)ethyl]hydrazine
CID 105330355
[1-(2-bromo-3-fluorophenyl)-2-(4-ethylphenyl)ethyl]hydrazine
CID 105287879
[1-(3-chloro-2-methylphenyl)-2-thiophen-2-ylethyl]hydrazine
CID 107103630
[1-(3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine
CID 105193135
[1-(2-ethylphenyl)-2-thiophen-2-ylethyl]hydrazine
CID 105295586
1-(2-chloro-3-fluorophenyl)-N-ethyl-2-thiophen-2-ylethanamine
CID 81453728
[1-(2-methylthiophen-3-yl)-2-thiophen-2-ylethyl]hydrazine
CID 102842712
[1-(2-bromo-3-fluorophenyl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105340815

Frequently Asked Questions

What is the IUPAC name of [1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine?
The IUPAC name of [1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine (CID 105295484) is [1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine.
What is the SMILES notation for [1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine?
The canonical SMILES for [1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine is NNC(Cc1cccs1)c1cccc(F)c1Br.
What is the InChIKey of [1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine?
The InChIKey is FSQCHTWXAQTJKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12BrFN2S/c13-12-9(4-1-5-10(12)14)11(16-15)7-8-3-2-6-17-8/h1-6,11,16H,7,15H2.
What are the key properties of [1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine?
[1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine has a molecular weight of 315.21 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-3-fluorophenyl)-2-thiophen-2-ylethyl]hydrazine is sourced from PubChem (CID 105295484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).