About 3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol
3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol (PubChem CID 114606467) has the molecular formula C15H18O
and a molecular weight of 214.31 g/mol. Its IUPAC name is 3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol.
Molecular Properties
| Compound Name | 3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol |
| PubChem CID | 114606467 |
| Molecular Formula | C15H18O |
| Molecular Weight | 214.31 g/mol |
| Exact Mass | 214.14 |
| IUPAC Name | 3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol |
| SMILES | OC1C=C(c2cccc(C3CCC3)c2)CC1 |
| InChI | InChI=1S/C15H18O/c16-15-8-7-14(10-15)13-6-2-5-12(9-13)11-3-1-4-11/h2,5-6,9-11,15-16H,1,3-4,7-8H2 |
| InChIKey | DJPDRMZLHFVMSY-UHFFFAOYSA-N |
| XLogP | 3.49 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 214.31 |
| LogP ≤ 5 | 3.49 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol?
The IUPAC name of 3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol (CID 114606467) is 3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol.
What is the SMILES notation for 3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol?
The canonical SMILES for 3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol is OC1C=C(c2cccc(C3CCC3)c2)CC1.
What is the InChIKey of 3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol?
The InChIKey is DJPDRMZLHFVMSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O/c16-15-8-7-14(10-15)13-6-2-5-12(9-13)11-3-1-4-11/h2,5-6,9-11,15-16H,1,3-4,7-8H2.
What are the key properties of 3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol?
3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol has a molecular weight of 214.31 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-cyclobutylphenyl)cyclopent-2-en-1-ol is sourced from PubChem (CID 114606467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).