About 4-(2-methylidenecyclopropyl)phenol
4-(2-methylidenecyclopropyl)phenol (PubChem CID 163485909) has the molecular formula C10H10O
and a molecular weight of 146.19 g/mol. Its IUPAC name is 4-(2-methylidenecyclopropyl)phenol.
Molecular Properties
| Compound Name | 4-(2-methylidenecyclopropyl)phenol |
| PubChem CID | 163485909 |
| Molecular Formula | C10H10O |
| Molecular Weight | 146.19 g/mol |
| Exact Mass | 146.07 |
| IUPAC Name | 4-(2-methylidenecyclopropyl)phenol |
| SMILES | C=C1CC1c1ccc(O)cc1 |
| InChI | InChI=1S/C10H10O/c1-7-6-10(7)8-2-4-9(11)5-3-8/h2-5,10-11H,1,6H2 |
| InChIKey | CINCDPARJZAMDA-UHFFFAOYSA-N |
| XLogP | 2.44 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 146.19 |
| LogP ≤ 5 | 2.44 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 4-(2-methylidenecyclopropyl)phenol?
The IUPAC name of 4-(2-methylidenecyclopropyl)phenol (CID 163485909) is 4-(2-methylidenecyclopropyl)phenol.
What is the SMILES notation for 4-(2-methylidenecyclopropyl)phenol?
The canonical SMILES for 4-(2-methylidenecyclopropyl)phenol is C=C1CC1c1ccc(O)cc1.
What is the InChIKey of 4-(2-methylidenecyclopropyl)phenol?
The InChIKey is CINCDPARJZAMDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O/c1-7-6-10(7)8-2-4-9(11)5-3-8/h2-5,10-11H,1,6H2.
What are the key properties of 4-(2-methylidenecyclopropyl)phenol?
4-(2-methylidenecyclopropyl)phenol has a molecular weight of 146.19 g/mol, XLogP of 2.44, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylidenecyclopropyl)phenol is sourced from PubChem (CID 163485909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).