F41
Summary
Name: | N-(1,3-benzodioxol-5-yl)-2-(piperidin-1-yl)acetamide |
Formula: | C14 H18 N2 O3 |
Formal charge: | 0 |
Formula weight: | 262.304 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N-(1,3-benzodioxol-5-yl)-2-(piperidin-1-yl)acetamide |
OpenEye OEToolkits | 1.7.0 | N-(1,3-benzodioxol-5-yl)-2-piperidin-1-yl-ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(Nc1ccc2OCOc2c1)CN3CCCCC3 |
SMILES_CANONICAL | CACTVS | 3.370 | O=C(CN1CCCCC1)Nc2ccc3OCOc3c2 |
SMILES | CACTVS | 3.370 | O=C(CN1CCCCC1)Nc2ccc3OCOc3c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc2c(cc1NC(=O)CN3CCCCC3)OCO2 |
SMILES | OpenEye OEToolkits | 1.7.0 | c1cc2c(cc1NC(=O)CN3CCCCC3)OCO2 |
InChI | InChI | 1.03 | InChI=1S/C14H18N2O3/c17-14(9-16-6-2-1-3-7-16)15-11-4-5-12-13(8-11)19-10-18-12/h4-5,8H,1-3,6-7,9-10H2,(H,15,17) |
InChIKey | InChI | 1.03 | KUAQEDPYOBHGFT-UHFFFAOYSA-N |