About 4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol
4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol (PubChem CID 114762706) has the molecular formula C11H21NOS
and a molecular weight of 215.36 g/mol. Its IUPAC name is 4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol.
Molecular Properties
| Compound Name | 4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol |
| PubChem CID | 114762706 |
| Molecular Formula | C11H21NOS |
| Molecular Weight | 215.36 g/mol |
| Exact Mass | 215.13 |
| IUPAC Name | 4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol |
| SMILES | CC1CN(C2CCC(O)CC2)CCS1 |
| InChI | InChI=1S/C11H21NOS/c1-9-8-12(6-7-14-9)10-2-4-11(13)5-3-10/h9-11,13H,2-8H2,1H3 |
| InChIKey | USLUJHBRPHTXGG-UHFFFAOYSA-N |
| XLogP | 1.73 |
| TPSA | 23.47 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 215.36 |
| LogP ≤ 5 | 1.73 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol?
The IUPAC name of 4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol (CID 114762706) is 4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol?
The canonical SMILES for 4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol is CC1CN(C2CCC(O)CC2)CCS1.
What is the InChIKey of 4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol?
The InChIKey is USLUJHBRPHTXGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NOS/c1-9-8-12(6-7-14-9)10-2-4-11(13)5-3-10/h9-11,13H,2-8H2,1H3.
What are the key properties of 4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol?
4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol has a molecular weight of 215.36 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylthiomorpholin-4-yl)cyclohexan-1-ol is sourced from PubChem (CID 114762706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).