About 2-(2-propan-2-ylhydrazinyl)ethanol
2-(2-propan-2-ylhydrazinyl)ethanol (PubChem CID 3946934) has the molecular formula C5H14N2O
and a molecular weight of 118.18 g/mol. Its IUPAC name is 2-(2-propan-2-ylhydrazinyl)ethanol.
Molecular Properties
| Compound Name | 2-(2-propan-2-ylhydrazinyl)ethanol |
| PubChem CID | 3946934 |
| Molecular Formula | C5H14N2O |
| Molecular Weight | 118.18 g/mol |
| Exact Mass | 118.11 |
| IUPAC Name | 2-(2-propan-2-ylhydrazinyl)ethanol |
| SMILES | CC(C)NNCCO |
| InChI | InChI=1S/C5H14N2O/c1-5(2)7-6-3-4-8/h5-8H,3-4H2,1-2H3 |
| InChIKey | AOKOZVAZQTXMHX-UHFFFAOYSA-N |
| XLogP | -0.52 |
| TPSA | 44.29 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 8 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 118.18 |
| LogP ≤ 5 | -0.52 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|
Analyze 2-(2-propan-2-ylhydrazinyl)ethanol with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 2-(2-propan-2-ylhydrazinyl)ethanol?
The IUPAC name of 2-(2-propan-2-ylhydrazinyl)ethanol (CID 3946934) is 2-(2-propan-2-ylhydrazinyl)ethanol.
What is the SMILES notation for 2-(2-propan-2-ylhydrazinyl)ethanol?
The canonical SMILES for 2-(2-propan-2-ylhydrazinyl)ethanol is CC(C)NNCCO.
What is the InChIKey of 2-(2-propan-2-ylhydrazinyl)ethanol?
The InChIKey is AOKOZVAZQTXMHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2O/c1-5(2)7-6-3-4-8/h5-8H,3-4H2,1-2H3.
What are the key properties of 2-(2-propan-2-ylhydrazinyl)ethanol?
2-(2-propan-2-ylhydrazinyl)ethanol has a molecular weight of 118.18 g/mol, XLogP of -0.52, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-ylhydrazinyl)ethanol is sourced from PubChem (CID 3946934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).