About N-cyclopentylthiomorpholine-4-carboxamide
N-cyclopentylthiomorpholine-4-carboxamide (PubChem CID 115582925) has the molecular formula C10H18N2OS
and a molecular weight of 214.33 g/mol. Its IUPAC name is N-cyclopentylthiomorpholine-4-carboxamide.
Molecular Properties
| Compound Name | N-cyclopentylthiomorpholine-4-carboxamide |
| PubChem CID | 115582925 |
| Molecular Formula | C10H18N2OS |
| Molecular Weight | 214.33 g/mol |
| Exact Mass | 214.11 |
| IUPAC Name | N-cyclopentylthiomorpholine-4-carboxamide |
| SMILES | O=C(NC1CCCC1)N1CCSCC1 |
| InChI | InChI=1S/C10H18N2OS/c13-10(11-9-3-1-2-4-9)12-5-7-14-8-6-12/h9H,1-8H2,(H,11,13) |
| InChIKey | NCYJJBAZNHETHV-UHFFFAOYSA-N |
| XLogP | 1.69 |
| TPSA | 32.34 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 214.33 |
| LogP ≤ 5 | 1.69 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-cyclopentylthiomorpholine-4-carboxamide?
The IUPAC name of N-cyclopentylthiomorpholine-4-carboxamide (CID 115582925) is N-cyclopentylthiomorpholine-4-carboxamide.
What is the SMILES notation for N-cyclopentylthiomorpholine-4-carboxamide?
The canonical SMILES for N-cyclopentylthiomorpholine-4-carboxamide is O=C(NC1CCCC1)N1CCSCC1.
What is the InChIKey of N-cyclopentylthiomorpholine-4-carboxamide?
The InChIKey is NCYJJBAZNHETHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c13-10(11-9-3-1-2-4-9)12-5-7-14-8-6-12/h9H,1-8H2,(H,11,13).
What are the key properties of N-cyclopentylthiomorpholine-4-carboxamide?
N-cyclopentylthiomorpholine-4-carboxamide has a molecular weight of 214.33 g/mol, XLogP of 1.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentylthiomorpholine-4-carboxamide is sourced from PubChem (CID 115582925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).