About 1-(2-methylbutyl)-2-propylcyclopropane
1-(2-methylbutyl)-2-propylcyclopropane (PubChem CID 90912055) has the molecular formula C11H22
and a molecular weight of 154.30 g/mol. Its IUPAC name is 1-(2-methylbutyl)-2-propylcyclopropane.
Molecular Properties
| Compound Name | 1-(2-methylbutyl)-2-propylcyclopropane |
| PubChem CID | 90912055 |
| Molecular Formula | C11H22 |
| Molecular Weight | 154.30 g/mol |
| Exact Mass | 154.17 |
| IUPAC Name | 1-(2-methylbutyl)-2-propylcyclopropane |
| SMILES | CCCC1CC1CC(C)CC |
| InChI | InChI=1S/C11H22/c1-4-6-10-8-11(10)7-9(3)5-2/h9-11H,4-8H2,1-3H3 |
| InChIKey | SMRFTGCMQOHCQA-UHFFFAOYSA-N |
| XLogP | 3.86 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 5 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 154.30 |
| LogP ≤ 5 | 3.86 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of 1-(2-methylbutyl)-2-propylcyclopropane?
The IUPAC name of 1-(2-methylbutyl)-2-propylcyclopropane (CID 90912055) is 1-(2-methylbutyl)-2-propylcyclopropane.
What is the SMILES notation for 1-(2-methylbutyl)-2-propylcyclopropane?
The canonical SMILES for 1-(2-methylbutyl)-2-propylcyclopropane is CCCC1CC1CC(C)CC.
What is the InChIKey of 1-(2-methylbutyl)-2-propylcyclopropane?
The InChIKey is SMRFTGCMQOHCQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22/c1-4-6-10-8-11(10)7-9(3)5-2/h9-11H,4-8H2,1-3H3.
What are the key properties of 1-(2-methylbutyl)-2-propylcyclopropane?
1-(2-methylbutyl)-2-propylcyclopropane has a molecular weight of 154.30 g/mol, XLogP of 3.86, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylbutyl)-2-propylcyclopropane is sourced from PubChem (CID 90912055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).