[1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine

C13H15BrN2S — CID 105283168

IUPAC[1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine
SMILESCc1cc(C(Cc2ccccc2)NN)sc1Br
InChIInChI=1S/C13H15BrN2S/c1-9-7-12(17-13(9)14)11(16-15)8-10-5-3-2-4-6-10/h2-7,11,16H,8,15H2,1H3
InChIKeyFFOWEHYIRXQPGH-UHFFFAOYSA-N
MW311.25 g/mol
LogP3.57
Rot. Bonds4

About [1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine

[1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine (PubChem CID 105283168) has the molecular formula C13H15BrN2S and a molecular weight of 311.25 g/mol. Its IUPAC name is [1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine
PubChem CID105283168
Molecular FormulaC13H15BrN2S
Molecular Weight311.25 g/mol
Exact Mass310.01
IUPAC Name[1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine
SMILESCc1cc(C(Cc2ccccc2)NN)sc1Br
InChIInChI=1S/C13H15BrN2S/c1-9-7-12(17-13(9)14)11(16-15)8-10-5-3-2-4-6-10/h2-7,11,16H,8,15H2,1H3
InChIKeyFFOWEHYIRXQPGH-UHFFFAOYSA-N
XLogP3.57
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.25
LogP ≤ 53.57
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-(5-bromo-4-methylthiophen-2-yl)-2-(1-methylbenzimidazol-2-yl)ethyl]hydrazine
CID 105321073
[1-(5-bromo-4-methylthiophen-2-yl)-4,4,4-trifluorobutyl]hydrazine
CID 105313942
[1-(5-bromo-4-methylthiophen-2-yl)-4,4-dimethylpentyl]hydrazine
CID 105300069
[1-(5-bromo-4-methylthiophen-2-yl)-2-(2,5-dimethylpyrazol-3-yl)ethyl]hydrazine
CID 105315837
1-(4,5-dimethylthiophen-2-yl)-N-methyl-2-phenylethanamine
CID 65238920
[1-(5-bromo-4-methylthiophen-2-yl)-3-methylsulfonylpropyl]hydrazine
CID 114985173
1-(5-bromo-4-methylthiophen-2-yl)heptylhydrazine
CID 105294058
1-(5-bromo-4-methylthiophen-2-yl)-N-ethyl-2-(4-iodophenyl)ethanamine
CID 115863981
[2-phenyl-1-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105283121
[1-(5-bromo-4-methylthiophen-2-yl)-2-(1-ethylimidazol-2-yl)ethyl]hydrazine
CID 105321894
1-(5-bromo-4-methylthiophen-2-yl)-N-methylpropan-1-amine
CID 79991964
[1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine
CID 105195292

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine?
The IUPAC name of [1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine (CID 105283168) is [1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine.
What is the SMILES notation for [1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine?
The canonical SMILES for [1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine is Cc1cc(C(Cc2ccccc2)NN)sc1Br.
What is the InChIKey of [1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine?
The InChIKey is FFOWEHYIRXQPGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN2S/c1-9-7-12(17-13(9)14)11(16-15)8-10-5-3-2-4-6-10/h2-7,11,16H,8,15H2,1H3.
What are the key properties of [1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine?
[1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine has a molecular weight of 311.25 g/mol, XLogP of 3.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromo-4-methylthiophen-2-yl)-2-phenylethyl]hydrazine is sourced from PubChem (CID 105283168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).