rel-(3R,4R)-1-(3-fluoropyridine-2-carbonyl)-4-(hydroxymethyl)-N-methylpyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-(3-fluoropyridine-2-carbonyl)-4-(hydroxymethyl)-N-methylpyrrolidine-3-carboxamide
rel-(3R,4R)-1-(3-fluoropyridine-2-carbonyl)-4-(hydroxymethyl)-N-methylpyrrolidine-3-carboxamide
Compound characteristics
Compound ID: | S836-1429 |
Compound Name: | rel-(3R,4R)-1-(3-fluoropyridine-2-carbonyl)-4-(hydroxymethyl)-N-methylpyrrolidine-3-carboxamide |
Molecular Weight: | 281.28 |
Molecular Formula: | C13 H16 F N3 O3 |
Smiles: | CNC([C@@H]1CN(C[C@H]1CO)C(c1c(cccn1)F)=O)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | -0.9842 |
logD: | -0.9842 |
logSw: | -1.6363 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.888 |
InChI Key: | NCAMDRYNPVYTPA-DTWKUNHWSA-N |