About 1-cyclohexylsulfanylpropan-2-ylhydrazine
1-cyclohexylsulfanylpropan-2-ylhydrazine (PubChem CID 105227877) has the molecular formula C9H20N2S
and a molecular weight of 188.34 g/mol. Its IUPAC name is 1-cyclohexylsulfanylpropan-2-ylhydrazine.
Molecular Properties
| Compound Name | 1-cyclohexylsulfanylpropan-2-ylhydrazine |
| PubChem CID | 105227877 |
| Molecular Formula | C9H20N2S |
| Molecular Weight | 188.34 g/mol |
| Exact Mass | 188.13 |
| IUPAC Name | 1-cyclohexylsulfanylpropan-2-ylhydrazine |
| SMILES | CC(CSC1CCCCC1)NN |
| InChI | InChI=1S/C9H20N2S/c1-8(11-10)7-12-9-5-3-2-4-6-9/h8-9,11H,2-7,10H2,1H3 |
| InChIKey | WLLHUFZZAGCJOF-UHFFFAOYSA-N |
| XLogP | 1.90 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 188.34 |
| LogP ≤ 5 | 1.90 |
| 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-cyclohexylsulfanylpropan-2-ylhydrazine?
The IUPAC name of 1-cyclohexylsulfanylpropan-2-ylhydrazine (CID 105227877) is 1-cyclohexylsulfanylpropan-2-ylhydrazine.
What is the SMILES notation for 1-cyclohexylsulfanylpropan-2-ylhydrazine?
The canonical SMILES for 1-cyclohexylsulfanylpropan-2-ylhydrazine is CC(CSC1CCCCC1)NN.
What is the InChIKey of 1-cyclohexylsulfanylpropan-2-ylhydrazine?
The InChIKey is WLLHUFZZAGCJOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2S/c1-8(11-10)7-12-9-5-3-2-4-6-9/h8-9,11H,2-7,10H2,1H3.
What are the key properties of 1-cyclohexylsulfanylpropan-2-ylhydrazine?
1-cyclohexylsulfanylpropan-2-ylhydrazine has a molecular weight of 188.34 g/mol, XLogP of 1.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexylsulfanylpropan-2-ylhydrazine is sourced from PubChem (CID 105227877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).