About (2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol
(2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol (PubChem CID 106790887) has the molecular formula C18H22O3
and a molecular weight of 286.37 g/mol. Its IUPAC name is (2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol.
Molecular Properties
| Compound Name | (2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol |
| PubChem CID | 106790887 |
| Molecular Formula | C18H22O3 |
| Molecular Weight | 286.37 g/mol |
| Exact Mass | 286.16 |
| IUPAC Name | (2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol |
| SMILES | COc1cc(C)ccc1C(O)c1ccc(OC(C)C)cc1 |
| InChI | InChI=1S/C18H22O3/c1-12(2)21-15-8-6-14(7-9-15)18(19)16-10-5-13(3)11-17(16)20-4/h5-12,18-19H,1-4H3 |
| InChIKey | ZFKYDQGDGYXHGX-UHFFFAOYSA-N |
| XLogP | 3.87 |
| TPSA | 38.69 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 286.37 |
| LogP ≤ 5 | 3.87 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Analyze (2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol 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-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol?
The IUPAC name of (2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol (CID 106790887) is (2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol.
What is the SMILES notation for (2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol?
The canonical SMILES for (2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol is COc1cc(C)ccc1C(O)c1ccc(OC(C)C)cc1.
What is the InChIKey of (2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol?
The InChIKey is ZFKYDQGDGYXHGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O3/c1-12(2)21-15-8-6-14(7-9-15)18(19)16-10-5-13(3)11-17(16)20-4/h5-12,18-19H,1-4H3.
What are the key properties of (2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol?
(2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol has a molecular weight of 286.37 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-4-methylphenyl)-(4-propan-2-yloxyphenyl)methanol is sourced from PubChem (CID 106790887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).