About 1-methoxy-2-(2-methylcyclopropyl)benzene
1-methoxy-2-(2-methylcyclopropyl)benzene (PubChem CID 12651013) has the molecular formula C11H14O
and a molecular weight of 162.23 g/mol. Its IUPAC name is 1-methoxy-2-(2-methylcyclopropyl)benzene.
Molecular Properties
| Compound Name | 1-methoxy-2-(2-methylcyclopropyl)benzene |
| PubChem CID | 12651013 |
| Molecular Formula | C11H14O |
| Molecular Weight | 162.23 g/mol |
| Exact Mass | 162.10 |
| IUPAC Name | 1-methoxy-2-(2-methylcyclopropyl)benzene |
| SMILES | COc1ccccc1C1CC1C |
| InChI | InChI=1S/C11H14O/c1-8-7-10(8)9-5-3-4-6-11(9)12-2/h3-6,8,10H,7H2,1-2H3 |
| InChIKey | YJXYJOMFHBVQFP-UHFFFAOYSA-N |
| XLogP | 2.82 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 162.23 |
| LogP ≤ 5 | 2.82 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 1-methoxy-2-(2-methylcyclopropyl)benzene?
The IUPAC name of 1-methoxy-2-(2-methylcyclopropyl)benzene (CID 12651013) is 1-methoxy-2-(2-methylcyclopropyl)benzene.
What is the SMILES notation for 1-methoxy-2-(2-methylcyclopropyl)benzene?
The canonical SMILES for 1-methoxy-2-(2-methylcyclopropyl)benzene is COc1ccccc1C1CC1C.
What is the InChIKey of 1-methoxy-2-(2-methylcyclopropyl)benzene?
The InChIKey is YJXYJOMFHBVQFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O/c1-8-7-10(8)9-5-3-4-6-11(9)12-2/h3-6,8,10H,7H2,1-2H3.
What are the key properties of 1-methoxy-2-(2-methylcyclopropyl)benzene?
1-methoxy-2-(2-methylcyclopropyl)benzene has a molecular weight of 162.23 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-(2-methylcyclopropyl)benzene is sourced from PubChem (CID 12651013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).