About [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine
[1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine (PubChem CID 105222482) has the molecular formula C11H19BrN2S
and a molecular weight of 291.26 g/mol. Its IUPAC name is [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine.
Molecular Properties
| Compound Name | [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine |
| PubChem CID | 105222482 |
| Molecular Formula | C11H19BrN2S |
| Molecular Weight | 291.26 g/mol |
| Exact Mass | 290.05 |
| IUPAC Name | [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine |
| SMILES | CCCC(C)CC(NN)c1cc(Br)cs1 |
| InChI | InChI=1S/C11H19BrN2S/c1-3-4-8(2)5-10(14-13)11-6-9(12)7-15-11/h6-8,10,14H,3-5,13H2,1-2H3 |
| InChIKey | AMZOGVMPLOTZKV-UHFFFAOYSA-N |
| XLogP | 3.84 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 291.26 |
| LogP ≤ 5 | 3.84 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine?
The IUPAC name of [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine (CID 105222482) is [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine.
What is the SMILES notation for [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine?
The canonical SMILES for [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine is CCCC(C)CC(NN)c1cc(Br)cs1.
What is the InChIKey of [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine?
The InChIKey is AMZOGVMPLOTZKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19BrN2S/c1-3-4-8(2)5-10(14-13)11-6-9(12)7-15-11/h6-8,10,14H,3-5,13H2,1-2H3.
What are the key properties of [1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine?
[1-(4-bromothiophen-2-yl)-3-methylhexyl]hydrazine has a molecular weight of 291.26 g/mol, XLogP of 3.84, 6 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)-3-methylhexyl]hydrazine is sourced from PubChem (CID 105222482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).