About N-(oxolan-3-yl)cyclohexanecarboxamide
N-(oxolan-3-yl)cyclohexanecarboxamide (PubChem CID 110868779) has the molecular formula C11H19NO2
and a molecular weight of 197.28 g/mol. Its IUPAC name is N-(oxolan-3-yl)cyclohexanecarboxamide.
Molecular Properties
| Compound Name | N-(oxolan-3-yl)cyclohexanecarboxamide |
| PubChem CID | 110868779 |
| Molecular Formula | C11H19NO2 |
| Molecular Weight | 197.28 g/mol |
| Exact Mass | 197.14 |
| IUPAC Name | N-(oxolan-3-yl)cyclohexanecarboxamide |
| SMILES | O=C(NC1CCOC1)C1CCCCC1 |
| InChI | InChI=1S/C11H19NO2/c13-11(9-4-2-1-3-5-9)12-10-6-7-14-8-10/h9-10H,1-8H2,(H,12,13) |
| InChIKey | ANBHHGGUYSELIB-UHFFFAOYSA-N |
| XLogP | 1.47 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 197.28 |
| LogP ≤ 5 | 1.47 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(oxolan-3-yl)cyclohexanecarboxamide?
The IUPAC name of N-(oxolan-3-yl)cyclohexanecarboxamide (CID 110868779) is N-(oxolan-3-yl)cyclohexanecarboxamide.
What is the SMILES notation for N-(oxolan-3-yl)cyclohexanecarboxamide?
The canonical SMILES for N-(oxolan-3-yl)cyclohexanecarboxamide is O=C(NC1CCOC1)C1CCCCC1.
What is the InChIKey of N-(oxolan-3-yl)cyclohexanecarboxamide?
The InChIKey is ANBHHGGUYSELIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c13-11(9-4-2-1-3-5-9)12-10-6-7-14-8-10/h9-10H,1-8H2,(H,12,13).
What are the key properties of N-(oxolan-3-yl)cyclohexanecarboxamide?
N-(oxolan-3-yl)cyclohexanecarboxamide has a molecular weight of 197.28 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-3-yl)cyclohexanecarboxamide is sourced from PubChem (CID 110868779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).