About [(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol
[(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol (PubChem CID 11051860) has the molecular formula C10H16O
and a molecular weight of 152.24 g/mol. Its IUPAC name is [(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol.
Molecular Properties
| Compound Name | [(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol |
| PubChem CID | 11051860 |
| Molecular Formula | C10H16O |
| Molecular Weight | 152.24 g/mol |
| Exact Mass | 152.12 |
| IUPAC Name | [(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol |
| SMILES | C=C(C)[C@@H]1CCC(C)=C1CO |
| InChI | InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(9)6-11/h9,11H,1,4-6H2,2-3H3/t9-/m0/s1 |
| InChIKey | KIGJGCPWLLIPBZ-VIFPVBQESA-N |
| XLogP | 2.28 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 152.24 |
| LogP ≤ 5 | 2.28 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol?
The IUPAC name of [(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol (CID 11051860) is [(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol.
What is the SMILES notation for [(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol?
The canonical SMILES for [(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol is C=C(C)[C@@H]1CCC(C)=C1CO.
What is the InChIKey of [(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol?
The InChIKey is KIGJGCPWLLIPBZ-VIFPVBQESA-N. The full InChI is InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(9)6-11/h9,11H,1,4-6H2,2-3H3/t9-/m0/s1.
What are the key properties of [(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol?
[(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol has a molecular weight of 152.24 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(5S)-2-methyl-5-prop-1-en-2-ylcyclopenten-1-yl]methanol is sourced from PubChem (CID 11051860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).