1-(4-bromothiophen-2-yl)butan-2-ylhydrazine

C8H13BrN2S — CID 105201113

IUPAC1-(4-bromothiophen-2-yl)butan-2-ylhydrazine
SMILESCCC(Cc1cc(Br)cs1)NN
InChIInChI=1S/C8H13BrN2S/c1-2-7(11-10)4-8-3-6(9)5-12-8/h3,5,7,11H,2,4,10H2,1H3
InChIKeyLYSLTEUAGHHSEB-UHFFFAOYSA-N
MW249.18 g/mol
LogP2.30
Rot. Bonds4

About 1-(4-bromothiophen-2-yl)butan-2-ylhydrazine

1-(4-bromothiophen-2-yl)butan-2-ylhydrazine (PubChem CID 105201113) has the molecular formula C8H13BrN2S and a molecular weight of 249.18 g/mol. Its IUPAC name is 1-(4-bromothiophen-2-yl)butan-2-ylhydrazine.

Molecular Properties

Compound Name1-(4-bromothiophen-2-yl)butan-2-ylhydrazine
PubChem CID105201113
Molecular FormulaC8H13BrN2S
Molecular Weight249.18 g/mol
Exact Mass248.00
IUPAC Name1-(4-bromothiophen-2-yl)butan-2-ylhydrazine
SMILESCCC(Cc1cc(Br)cs1)NN
InChIInChI=1S/C8H13BrN2S/c1-2-7(11-10)4-8-3-6(9)5-12-8/h3,5,7,11H,2,4,10H2,1H3
InChIKeyLYSLTEUAGHHSEB-UHFFFAOYSA-N
XLogP2.30
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.18
LogP ≤ 52.30
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-(4-bromothiophen-2-yl)-3-methylsulfanylpropan-2-yl]hydrazine
CID 105214014
[1-(4-bromothiophen-2-yl)-3-ethylsulfanylpropan-2-yl]hydrazine
CID 105225472
1-(4-bromothiophen-2-yl)-N-propylbutan-2-amine
CID 62601735
[1-(4-bromothiophen-2-yl)-3-methylsulfonylpropan-2-yl]hydrazine
CID 105299404
[1-(4-bromothiophen-2-yl)-5-methoxy-4-methylpentan-2-yl]hydrazine
CID 105299395
[1-(4-bromothiophen-2-yl)-3-cyclopentylpropan-2-yl]hydrazine
CID 105299335
[1-(4-bromothiophen-2-yl)-3-(4-chlorophenyl)propan-2-yl]hydrazine
CID 105197753
2-[(4-bromothiophen-2-yl)methyl]butan-1-amine
CID 62503815
[2-(4-bromothiophen-2-yl)-1-(3-ethylthiophen-2-yl)ethyl]hydrazine
CID 105299228
1-(4-bromothiophen-2-yl)-N-ethyl-3-methylsulfanylpropan-2-amine
CID 62691752
1-(4-bromothiophen-2-yl)-3-ethyl-2-hydrazinyl-N,N-dimethylpentan-3-amine
CID 105241832
[1-(4-bromothiophen-2-yl)-3-ethyl-3-methoxypentan-2-yl]hydrazine
CID 105275510

Frequently Asked Questions

What is the IUPAC name of 1-(4-bromothiophen-2-yl)butan-2-ylhydrazine?
The IUPAC name of 1-(4-bromothiophen-2-yl)butan-2-ylhydrazine (CID 105201113) is 1-(4-bromothiophen-2-yl)butan-2-ylhydrazine.
What is the SMILES notation for 1-(4-bromothiophen-2-yl)butan-2-ylhydrazine?
The canonical SMILES for 1-(4-bromothiophen-2-yl)butan-2-ylhydrazine is CCC(Cc1cc(Br)cs1)NN.
What is the InChIKey of 1-(4-bromothiophen-2-yl)butan-2-ylhydrazine?
The InChIKey is LYSLTEUAGHHSEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13BrN2S/c1-2-7(11-10)4-8-3-6(9)5-12-8/h3,5,7,11H,2,4,10H2,1H3.
What are the key properties of 1-(4-bromothiophen-2-yl)butan-2-ylhydrazine?
1-(4-bromothiophen-2-yl)butan-2-ylhydrazine has a molecular weight of 249.18 g/mol, XLogP of 2.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-bromothiophen-2-yl)butan-2-ylhydrazine is sourced from PubChem (CID 105201113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).