About 2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol
2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol (PubChem CID 83173147) has the molecular formula C15H18O2
and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol.
Molecular Properties
| Compound Name | 2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol |
| PubChem CID | 83173147 |
| Molecular Formula | C15H18O2 |
| Molecular Weight | 230.31 g/mol |
| Exact Mass | 230.13 |
| IUPAC Name | 2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol |
| SMILES | CC(C)c1ccc(C(O)Cc2ccoc2)cc1 |
| InChI | InChI=1S/C15H18O2/c1-11(2)13-3-5-14(6-4-13)15(16)9-12-7-8-17-10-12/h3-8,10-11,15-16H,9H2,1-2H3 |
| InChIKey | IKIULXQNTLKFAW-UHFFFAOYSA-N |
| XLogP | 3.68 |
| TPSA | 33.37 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 230.31 |
| LogP ≤ 5 | 3.68 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol?
The IUPAC name of 2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol (CID 83173147) is 2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol.
What is the SMILES notation for 2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol?
The canonical SMILES for 2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol is CC(C)c1ccc(C(O)Cc2ccoc2)cc1.
What is the InChIKey of 2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol?
The InChIKey is IKIULXQNTLKFAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O2/c1-11(2)13-3-5-14(6-4-13)15(16)9-12-7-8-17-10-12/h3-8,10-11,15-16H,9H2,1-2H3.
What are the key properties of 2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol?
2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol has a molecular weight of 230.31 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-1-(4-propan-2-ylphenyl)ethanol is sourced from PubChem (CID 83173147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).