About [1-(4-chlorophenyl)cyclopentyl]methanol
[1-(4-chlorophenyl)cyclopentyl]methanol (PubChem CID 2724017) has the molecular formula C12H15ClO
and a molecular weight of 210.70 g/mol. Its IUPAC name is [1-(4-chlorophenyl)cyclopentyl]methanol.
Molecular Properties
| Compound Name | [1-(4-chlorophenyl)cyclopentyl]methanol |
| PubChem CID | 2724017 |
| Molecular Formula | C12H15ClO |
| Molecular Weight | 210.70 g/mol |
| Exact Mass | 210.08 |
| IUPAC Name | [1-(4-chlorophenyl)cyclopentyl]methanol |
| SMILES | OCC1(c2ccc(Cl)cc2)CCCC1 |
| InChI | InChI=1S/C12H15ClO/c13-11-5-3-10(4-6-11)12(9-14)7-1-2-8-12/h3-6,14H,1-2,7-9H2 |
| InChIKey | JPVGEFSYKNYYAU-UHFFFAOYSA-N |
| XLogP | 3.14 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 210.70 |
| LogP ≤ 5 | 3.14 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of [1-(4-chlorophenyl)cyclopentyl]methanol?
The IUPAC name of [1-(4-chlorophenyl)cyclopentyl]methanol (CID 2724017) is [1-(4-chlorophenyl)cyclopentyl]methanol.
What is the SMILES notation for [1-(4-chlorophenyl)cyclopentyl]methanol?
The canonical SMILES for [1-(4-chlorophenyl)cyclopentyl]methanol is OCC1(c2ccc(Cl)cc2)CCCC1.
What is the InChIKey of [1-(4-chlorophenyl)cyclopentyl]methanol?
The InChIKey is JPVGEFSYKNYYAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClO/c13-11-5-3-10(4-6-11)12(9-14)7-1-2-8-12/h3-6,14H,1-2,7-9H2.
What are the key properties of [1-(4-chlorophenyl)cyclopentyl]methanol?
[1-(4-chlorophenyl)cyclopentyl]methanol has a molecular weight of 210.70 g/mol, XLogP of 3.14, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chlorophenyl)cyclopentyl]methanol is sourced from PubChem (CID 2724017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).