C12H19BrN2S — CID 105299335
[1-(4-bromothiophen-2-yl)-3-cyclopentylpropan-2-yl]hydrazine (PubChem CID 105299335) has the molecular formula C12H19BrN2S and a molecular weight of 303.27 g/mol. Its IUPAC name is [1-(4-bromothiophen-2-yl)-3-cyclopentylpropan-2-yl]hydrazine.
| Compound Name | [1-(4-bromothiophen-2-yl)-3-cyclopentylpropan-2-yl]hydrazine |
|---|---|
| PubChem CID | 105299335 |
| Molecular Formula | C12H19BrN2S |
| Molecular Weight | 303.27 g/mol |
| Exact Mass | 302.05 |
| IUPAC Name | [1-(4-bromothiophen-2-yl)-3-cyclopentylpropan-2-yl]hydrazine |
| SMILES | NNC(Cc1cc(Br)cs1)CC1CCCC1 |
| InChI | InChI=1S/C12H19BrN2S/c13-10-6-12(16-8-10)7-11(15-14)5-9-3-1-2-4-9/h6,8-9,11,15H,1-5,7,14H2 |
| InChIKey | GVZZVQXTQPPHDL-UHFFFAOYSA-N |
| XLogP | 3.47 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 16 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 303.27 |
| LogP ≤ 5 | 3.47 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|