About [1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol
[1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol (PubChem CID 61409018) has the molecular formula C11H22N2O3S
and a molecular weight of 262.37 g/mol. Its IUPAC name is [1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol.
Molecular Properties
| Compound Name | [1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol |
| PubChem CID | 61409018 |
| Molecular Formula | C11H22N2O3S |
| Molecular Weight | 262.37 g/mol |
| Exact Mass | 262.14 |
| IUPAC Name | [1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol |
| SMILES | CC1CCN(S(=O)(=O)N2CCCC2CO)CC1 |
| InChI | InChI=1S/C11H22N2O3S/c1-10-4-7-12(8-5-10)17(15,16)13-6-2-3-11(13)9-14/h10-11,14H,2-9H2,1H3 |
| InChIKey | ULVKJQNOYJSDPD-UHFFFAOYSA-N |
| XLogP | 0.42 |
| TPSA | 60.85 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 262.37 |
| LogP ≤ 5 | 0.42 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of [1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol?
The IUPAC name of [1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol (CID 61409018) is [1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol?
The canonical SMILES for [1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol is CC1CCN(S(=O)(=O)N2CCCC2CO)CC1.
What is the InChIKey of [1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol?
The InChIKey is ULVKJQNOYJSDPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-10-4-7-12(8-5-10)17(15,16)13-6-2-3-11(13)9-14/h10-11,14H,2-9H2,1H3.
What are the key properties of [1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol?
[1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol has a molecular weight of 262.37 g/mol, XLogP of 0.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-2-yl]methanol is sourced from PubChem (CID 61409018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).