About 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol
2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol (PubChem CID 55269055) has the molecular formula C9H11N3O2
and a molecular weight of 193.21 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol.
Molecular Properties
| Compound Name | 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol |
| PubChem CID | 55269055 |
| Molecular Formula | C9H11N3O2 |
| Molecular Weight | 193.21 g/mol |
| Exact Mass | 193.09 |
| IUPAC Name | 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol |
| SMILES | Nc1cnn(CC(O)c2ccco2)c1 |
| InChI | InChI=1S/C9H11N3O2/c10-7-4-11-12(5-7)6-8(13)9-2-1-3-14-9/h1-5,8,13H,6,10H2 |
| InChIKey | TWGOJPOBOMJRCR-UHFFFAOYSA-N |
| XLogP | 0.79 |
| TPSA | 77.21 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 193.21 |
| LogP ≤ 5 | 0.79 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol (CID 55269055) is 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol is Nc1cnn(CC(O)c2ccco2)c1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol?
The InChIKey is TWGOJPOBOMJRCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c10-7-4-11-12(5-7)6-8(13)9-2-1-3-14-9/h1-5,8,13H,6,10H2.
What are the key properties of 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol?
2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol has a molecular weight of 193.21 g/mol, XLogP of 0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol is sourced from PubChem (CID 55269055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).