About (Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol
(Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol (PubChem CID 131401182) has the molecular formula C11H14O
and a molecular weight of 162.23 g/mol. Its IUPAC name is (Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol.
Molecular Properties
| Compound Name | (Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol |
| PubChem CID | 131401182 |
| Molecular Formula | C11H14O |
| Molecular Weight | 162.23 g/mol |
| Exact Mass | 162.10 |
| IUPAC Name | (Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol |
| SMILES | C#CC(O)/C(C)=C\C1C=CCC1 |
| InChI | InChI=1S/C11H14O/c1-3-11(12)9(2)8-10-6-4-5-7-10/h1,4,6,8,10-12H,5,7H2,2H3/b9-8- |
| InChIKey | YKAKWDRCPPXZBF-HJWRWDBZSA-N |
| XLogP | 1.89 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| 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 | 1.89 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol?
The IUPAC name of (Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol (CID 131401182) is (Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol.
What is the SMILES notation for (Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol?
The canonical SMILES for (Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol is C#CC(O)/C(C)=C\C1C=CCC1.
What is the InChIKey of (Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol?
The InChIKey is YKAKWDRCPPXZBF-HJWRWDBZSA-N. The full InChI is InChI=1S/C11H14O/c1-3-11(12)9(2)8-10-6-4-5-7-10/h1,4,6,8,10-12H,5,7H2,2H3/b9-8-.
What are the key properties of (Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol?
(Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol has a molecular weight of 162.23 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-cyclopent-2-en-1-yl-2-methylpent-1-en-4-yn-3-ol is sourced from PubChem (CID 131401182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).