About (E)-5-naphthalen-2-ylpent-4-en-1-ol
(E)-5-naphthalen-2-ylpent-4-en-1-ol (PubChem CID 11252836) has the molecular formula C15H16O
and a molecular weight of 212.29 g/mol. Its IUPAC name is (E)-5-naphthalen-2-ylpent-4-en-1-ol.
Molecular Properties
| Compound Name | (E)-5-naphthalen-2-ylpent-4-en-1-ol |
| PubChem CID | 11252836 |
| Molecular Formula | C15H16O |
| Molecular Weight | 212.29 g/mol |
| Exact Mass | 212.12 |
| IUPAC Name | (E)-5-naphthalen-2-ylpent-4-en-1-ol |
| SMILES | OCCC/C=C/c1ccc2ccccc2c1 |
| InChI | InChI=1S/C15H16O/c16-11-5-1-2-6-13-9-10-14-7-3-4-8-15(14)12-13/h2-4,6-10,12,16H,1,5,11H2/b6-2+ |
| InChIKey | QWAXLQNIRVYKCV-QHHAFSJGSA-N |
| XLogP | 3.63 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 212.29 |
| LogP ≤ 5 | 3.63 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (E)-5-naphthalen-2-ylpent-4-en-1-ol?
The IUPAC name of (E)-5-naphthalen-2-ylpent-4-en-1-ol (CID 11252836) is (E)-5-naphthalen-2-ylpent-4-en-1-ol.
What is the SMILES notation for (E)-5-naphthalen-2-ylpent-4-en-1-ol?
The canonical SMILES for (E)-5-naphthalen-2-ylpent-4-en-1-ol is OCCC/C=C/c1ccc2ccccc2c1.
What is the InChIKey of (E)-5-naphthalen-2-ylpent-4-en-1-ol?
The InChIKey is QWAXLQNIRVYKCV-QHHAFSJGSA-N. The full InChI is InChI=1S/C15H16O/c16-11-5-1-2-6-13-9-10-14-7-3-4-8-15(14)12-13/h2-4,6-10,12,16H,1,5,11H2/b6-2+.
What are the key properties of (E)-5-naphthalen-2-ylpent-4-en-1-ol?
(E)-5-naphthalen-2-ylpent-4-en-1-ol has a molecular weight of 212.29 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-naphthalen-2-ylpent-4-en-1-ol is sourced from PubChem (CID 11252836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).