About [1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine
[1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine (PubChem CID 105195292) has the molecular formula C12H13ClN2S
and a molecular weight of 252.77 g/mol. Its IUPAC name is [1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine.
Molecular Properties
| Compound Name | [1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine |
| PubChem CID | 105195292 |
| Molecular Formula | C12H13ClN2S |
| Molecular Weight | 252.77 g/mol |
| Exact Mass | 252.05 |
| IUPAC Name | [1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine |
| SMILES | NNC(Cc1ccccc1)c1ccc(Cl)s1 |
| InChI | InChI=1S/C12H13ClN2S/c13-12-7-6-11(16-12)10(15-14)8-9-4-2-1-3-5-9/h1-7,10,15H,8,14H2 |
| InChIKey | QZKJIAKTKIOWKS-UHFFFAOYSA-N |
| XLogP | 3.15 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 252.77 |
| LogP ≤ 5 | 3.15 |
| 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-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine?
The IUPAC name of [1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine (CID 105195292) is [1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine.
What is the SMILES notation for [1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine?
The canonical SMILES for [1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine is NNC(Cc1ccccc1)c1ccc(Cl)s1.
What is the InChIKey of [1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine?
The InChIKey is QZKJIAKTKIOWKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN2S/c13-12-7-6-11(16-12)10(15-14)8-9-4-2-1-3-5-9/h1-7,10,15H,8,14H2.
What are the key properties of [1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine?
[1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine has a molecular weight of 252.77 g/mol, XLogP of 3.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-chlorothiophen-2-yl)-2-phenylethyl]hydrazine is sourced from PubChem (CID 105195292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).