About (E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol
(E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol (PubChem CID 130126250) has the molecular formula C10H12O
and a molecular weight of 148.20 g/mol. Its IUPAC name is (E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol.
Molecular Properties
| Compound Name | (E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol |
| PubChem CID | 130126250 |
| Molecular Formula | C10H12O |
| Molecular Weight | 148.20 g/mol |
| Exact Mass | 148.09 |
| IUPAC Name | (E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol |
| SMILES | OC/C=C/C#CC1=CCCC1 |
| InChI | InChI=1S/C10H12O/c11-9-5-1-2-6-10-7-3-4-8-10/h1,5,7,11H,3-4,8-9H2/b5-1+ |
| InChIKey | YXQFWCHVKYNSOU-ORCRQEGFSA-N |
| XLogP | 1.65 |
| 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 | 148.20 |
| LogP ≤ 5 | 1.65 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'triple_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol?
The IUPAC name of (E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol (CID 130126250) is (E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol.
What is the SMILES notation for (E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol?
The canonical SMILES for (E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol is OC/C=C/C#CC1=CCCC1.
What is the InChIKey of (E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol?
The InChIKey is YXQFWCHVKYNSOU-ORCRQEGFSA-N. The full InChI is InChI=1S/C10H12O/c11-9-5-1-2-6-10-7-3-4-8-10/h1,5,7,11H,3-4,8-9H2/b5-1+.
What are the key properties of (E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol?
(E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol has a molecular weight of 148.20 g/mol, XLogP of 1.65, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-(cyclopenten-1-yl)pent-2-en-4-yn-1-ol is sourced from PubChem (CID 130126250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).