N-cyclopentyl-2-(3-methylpiperidin-1-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
Chemical Structure Depiction of
N-cyclopentyl-2-(3-methylpiperidin-1-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
N-cyclopentyl-2-(3-methylpiperidin-1-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide
Compound characteristics
| Compound ID: | C094-2418 |
| Compound Name: | N-cyclopentyl-2-(3-methylpiperidin-1-yl)-2-(6-nitro-2H-1,3-benzodioxol-5-yl)acetamide |
| Molecular Weight: | 389.45 |
| Molecular Formula: | C20 H27 N3 O5 |
| Smiles: | CC1CCCN(C1)C(C(NC1CCCC1)=O)c1cc2c(cc1[N+]([O-])=O)OCO2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3772 |
| logD: | 2.3376 |
| logSw: | -3.9092 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.898 |
| InChI Key: | HIPHZGNFRQKINA-UHFFFAOYSA-N |