About (2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol
(2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol (PubChem CID 105095860) has the molecular formula C15H20N2O2
and a molecular weight of 260.34 g/mol. Its IUPAC name is (2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol.
Molecular Properties
| Compound Name | (2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol |
| PubChem CID | 105095860 |
| Molecular Formula | C15H20N2O2 |
| Molecular Weight | 260.34 g/mol |
| Exact Mass | 260.15 |
| IUPAC Name | (2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol |
| SMILES | CCOc1ccccc1C(O)c1cc(CC)nn1C |
| InChI | InChI=1S/C15H20N2O2/c1-4-11-10-13(17(3)16-11)15(18)12-8-6-7-9-14(12)19-5-2/h6-10,15,18H,4-5H2,1-3H3 |
| InChIKey | FCLJSQXVXSTDKB-UHFFFAOYSA-N |
| XLogP | 2.46 |
| TPSA | 47.28 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 260.34 |
| LogP ≤ 5 | 2.46 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of (2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol?
The IUPAC name of (2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol (CID 105095860) is (2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol.
What is the SMILES notation for (2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol?
The canonical SMILES for (2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol is CCOc1ccccc1C(O)c1cc(CC)nn1C.
What is the InChIKey of (2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol?
The InChIKey is FCLJSQXVXSTDKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-11-10-13(17(3)16-11)15(18)12-8-6-7-9-14(12)19-5-2/h6-10,15,18H,4-5H2,1-3H3.
What are the key properties of (2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol?
(2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol has a molecular weight of 260.34 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol is sourced from PubChem (CID 105095860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).