About 4-cyclopropyloxy-3-methoxyphenol
4-cyclopropyloxy-3-methoxyphenol (PubChem CID 84657279) has the molecular formula C10H12O3
and a molecular weight of 180.20 g/mol. Its IUPAC name is 4-cyclopropyloxy-3-methoxyphenol.
Molecular Properties
| Compound Name | 4-cyclopropyloxy-3-methoxyphenol |
| PubChem CID | 84657279 |
| Molecular Formula | C10H12O3 |
| Molecular Weight | 180.20 g/mol |
| Exact Mass | 180.08 |
| IUPAC Name | 4-cyclopropyloxy-3-methoxyphenol |
| SMILES | COc1cc(O)ccc1OC1CC1 |
| InChI | InChI=1S/C10H12O3/c1-12-10-6-7(11)2-5-9(10)13-8-3-4-8/h2,5-6,8,11H,3-4H2,1H3 |
| InChIKey | JEUXBHUWRMUIJS-UHFFFAOYSA-N |
| XLogP | 1.94 |
| TPSA | 38.69 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 180.20 |
| LogP ≤ 5 | 1.94 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-cyclopropyloxy-3-methoxyphenol?
The IUPAC name of 4-cyclopropyloxy-3-methoxyphenol (CID 84657279) is 4-cyclopropyloxy-3-methoxyphenol.
What is the SMILES notation for 4-cyclopropyloxy-3-methoxyphenol?
The canonical SMILES for 4-cyclopropyloxy-3-methoxyphenol is COc1cc(O)ccc1OC1CC1.
What is the InChIKey of 4-cyclopropyloxy-3-methoxyphenol?
The InChIKey is JEUXBHUWRMUIJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O3/c1-12-10-6-7(11)2-5-9(10)13-8-3-4-8/h2,5-6,8,11H,3-4H2,1H3.
What are the key properties of 4-cyclopropyloxy-3-methoxyphenol?
4-cyclopropyloxy-3-methoxyphenol has a molecular weight of 180.20 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyloxy-3-methoxyphenol is sourced from PubChem (CID 84657279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).