About 1-ethyl-2-pent-1-enylcyclopropane
1-ethyl-2-pent-1-enylcyclopropane (PubChem CID 123376012) has the molecular formula C10H18
and a molecular weight of 138.25 g/mol. Its IUPAC name is 1-ethyl-2-pent-1-enylcyclopropane.
Molecular Properties
| Compound Name | 1-ethyl-2-pent-1-enylcyclopropane |
| PubChem CID | 123376012 |
| Molecular Formula | C10H18 |
| Molecular Weight | 138.25 g/mol |
| Exact Mass | 138.14 |
| IUPAC Name | 1-ethyl-2-pent-1-enylcyclopropane |
| SMILES | CCCC=CC1CC1CC |
| InChI | InChI=1S/C10H18/c1-3-5-6-7-10-8-9(10)4-2/h6-7,9-10H,3-5,8H2,1-2H3 |
| InChIKey | DDUDRGUMJNZZFR-UHFFFAOYSA-N |
| XLogP | 3.39 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 4 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 138.25 |
| LogP ≤ 5 | 3.39 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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 1-ethyl-2-pent-1-enylcyclopropane?
The IUPAC name of 1-ethyl-2-pent-1-enylcyclopropane (CID 123376012) is 1-ethyl-2-pent-1-enylcyclopropane.
What is the SMILES notation for 1-ethyl-2-pent-1-enylcyclopropane?
The canonical SMILES for 1-ethyl-2-pent-1-enylcyclopropane is CCCC=CC1CC1CC.
What is the InChIKey of 1-ethyl-2-pent-1-enylcyclopropane?
The InChIKey is DDUDRGUMJNZZFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18/c1-3-5-6-7-10-8-9(10)4-2/h6-7,9-10H,3-5,8H2,1-2H3.
What are the key properties of 1-ethyl-2-pent-1-enylcyclopropane?
1-ethyl-2-pent-1-enylcyclopropane has a molecular weight of 138.25 g/mol, XLogP of 3.39, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-pent-1-enylcyclopropane is sourced from PubChem (CID 123376012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).