About N-cycloheptyl-3-methoxypropanamide
N-cycloheptyl-3-methoxypropanamide (PubChem CID 110839127) has the molecular formula C11H21NO2
and a molecular weight of 199.29 g/mol. Its IUPAC name is N-cycloheptyl-3-methoxypropanamide.
Molecular Properties
| Compound Name | N-cycloheptyl-3-methoxypropanamide |
| PubChem CID | 110839127 |
| Molecular Formula | C11H21NO2 |
| Molecular Weight | 199.29 g/mol |
| Exact Mass | 199.16 |
| IUPAC Name | N-cycloheptyl-3-methoxypropanamide |
| SMILES | COCCC(=O)NC1CCCCCC1 |
| InChI | InChI=1S/C11H21NO2/c1-14-9-8-11(13)12-10-6-4-2-3-5-7-10/h10H,2-9H2,1H3,(H,12,13) |
| InChIKey | FWAWLNAQCOZILZ-UHFFFAOYSA-N |
| XLogP | 1.86 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.29 |
| LogP ≤ 5 | 1.86 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-cycloheptyl-3-methoxypropanamide?
The IUPAC name of N-cycloheptyl-3-methoxypropanamide (CID 110839127) is N-cycloheptyl-3-methoxypropanamide.
What is the SMILES notation for N-cycloheptyl-3-methoxypropanamide?
The canonical SMILES for N-cycloheptyl-3-methoxypropanamide is COCCC(=O)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-3-methoxypropanamide?
The InChIKey is FWAWLNAQCOZILZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-14-9-8-11(13)12-10-6-4-2-3-5-7-10/h10H,2-9H2,1H3,(H,12,13).
What are the key properties of N-cycloheptyl-3-methoxypropanamide?
N-cycloheptyl-3-methoxypropanamide has a molecular weight of 199.29 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-3-methoxypropanamide is sourced from PubChem (CID 110839127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).