N-[rel-(3R,4R)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-4-(hydroxymethyl)piperidin-3-yl]pyridine-3-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4R)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-4-(hydroxymethyl)piperidin-3-yl]pyridine-3-carboxamide
N-[rel-(3R,4R)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-4-(hydroxymethyl)piperidin-3-yl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | S617-0870 |
| Compound Name: | N-[rel-(3R,4R)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-4-(hydroxymethyl)piperidin-3-yl]pyridine-3-carboxamide |
| Molecular Weight: | 357.45 |
| Molecular Formula: | C19 H27 N5 O2 |
| Smiles: | CCn1c(C)c(CN2CC[C@H](CO)[C@@H](C2)NC(c2cccnc2)=O)cn1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.0502 |
| logD: | -3.9086 |
| logSw: | -0.8817 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.799 |
| InChI Key: | IEZAVFTXBICWSQ-WMZOPIPTSA-N |