About 2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol
2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol (PubChem CID 104550145) has the molecular formula C10H19NO
and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol.
Molecular Properties
| Compound Name | 2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol |
| PubChem CID | 104550145 |
| Molecular Formula | C10H19NO |
| Molecular Weight | 169.27 g/mol |
| Exact Mass | 169.15 |
| IUPAC Name | 2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol |
| SMILES | CC1CCN1CC1CCCC1O |
| InChI | InChI=1S/C10H19NO/c1-8-5-6-11(8)7-9-3-2-4-10(9)12/h8-10,12H,2-7H2,1H3 |
| InChIKey | LLUPQCBYFWHKEE-UHFFFAOYSA-N |
| XLogP | 1.24 |
| TPSA | 23.47 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 169.27 |
| LogP ≤ 5 | 1.24 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol?
The IUPAC name of 2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol (CID 104550145) is 2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol is CC1CCN1CC1CCCC1O.
What is the InChIKey of 2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol?
The InChIKey is LLUPQCBYFWHKEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-8-5-6-11(8)7-9-3-2-4-10(9)12/h8-10,12H,2-7H2,1H3.
What are the key properties of 2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol?
2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol has a molecular weight of 169.27 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylazetidin-1-yl)methyl]cyclopentan-1-ol is sourced from PubChem (CID 104550145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).