About 2-(5-amino-3-methylpyrazol-1-yl)ethanol
2-(5-amino-3-methylpyrazol-1-yl)ethanol (PubChem CID 5018373) has the molecular formula C6H11N3O
and a molecular weight of 141.17 g/mol. Its IUPAC name is 2-(5-amino-3-methylpyrazol-1-yl)ethanol.
Molecular Properties
| Compound Name | 2-(5-amino-3-methylpyrazol-1-yl)ethanol |
| PubChem CID | 5018373 |
| Molecular Formula | C6H11N3O |
| Molecular Weight | 141.17 g/mol |
| Exact Mass | 141.09 |
| IUPAC Name | 2-(5-amino-3-methylpyrazol-1-yl)ethanol |
| SMILES | Cc1cc(N)n(CCO)n1 |
| InChI | InChI=1S/C6H11N3O/c1-5-4-6(7)9(8-5)2-3-10/h4,10H,2-3,7H2,1H3 |
| InChIKey | ANQYOZSPKNDFPD-UHFFFAOYSA-N |
| XLogP | -0.23 |
| TPSA | 64.07 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 141.17 |
| LogP ≤ 5 | -0.23 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-(5-amino-3-methylpyrazol-1-yl)ethanol?
The IUPAC name of 2-(5-amino-3-methylpyrazol-1-yl)ethanol (CID 5018373) is 2-(5-amino-3-methylpyrazol-1-yl)ethanol.
What is the SMILES notation for 2-(5-amino-3-methylpyrazol-1-yl)ethanol?
The canonical SMILES for 2-(5-amino-3-methylpyrazol-1-yl)ethanol is Cc1cc(N)n(CCO)n1.
What is the InChIKey of 2-(5-amino-3-methylpyrazol-1-yl)ethanol?
The InChIKey is ANQYOZSPKNDFPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-5-4-6(7)9(8-5)2-3-10/h4,10H,2-3,7H2,1H3.
What are the key properties of 2-(5-amino-3-methylpyrazol-1-yl)ethanol?
2-(5-amino-3-methylpyrazol-1-yl)ethanol has a molecular weight of 141.17 g/mol, XLogP of -0.23, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-3-methylpyrazol-1-yl)ethanol is sourced from PubChem (CID 5018373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).