(R)-5-(4,5-Dihydro-1H-imidazol-2-yl)-6-(3-hydroxypyrrolidin-1-yl)-N-(4-(trifluoromethoxy)phenyl)nicotinamide
Basic information
- Standard SMILES
O=C(Nc1ccc(OC(F)(F)F)cc1)c1cnc(N2CC[C@@H](O)C2)c(C2=NCCN2)c1- InChIKey
RDMFXXUMNXRTBR-CQSZACIVSA-N- Molecular formula
- C20H20F3N5O3
- Average molar mass
- 435.4 g/mol
Names & identifiers
- Preferred name
- (R)-5-(4,5-Dihydro-1H-imidazol-2-yl)-6-(3-hydroxypyrrolidin-1-yl)-N-(4-(trifluoromethoxy)phenyl)nicotinamide
- IUPAC
- 5-(4,5-dihydro-1H-imidazol-2-yl)-6-[(3R)-3-hydroxypyrrolidin-1-yl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
Names & synonyms
(R)-5-(4,5-Dihydro-1H-imidazol-2-yl)-6-(3-hydroxypyrrolidin-1-yl)-N-(4-(trifluoromethoxy)phenyl)nicotinamideSCHEMBL15393091
Database identifiers
- PubChem CID
- 89907994
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 99.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 669
Related reactions
1 records
Compound notes
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