Basic information
- Standard SMILES
CNC(=O)[C@H](CC(C)(C)C)NC(=O)c1ccc(C2CC2)c(OCC2CC2)n1- InChIKey
RUSMWNFLWLNSRI-KRWDZBQOSA-N- Molecular formula
- C21H31N3O3
- Average molar mass
- 373.5 g/mol
Names & identifiers
- Preferred name
- (S)-5-Cyclopropyl-6-(cyclopropylmethoxy)-N-(4,4-dimethyl-1-(methylamino)-1-oxopentan-2-yl)picolinamide
- IUPAC
- 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2S)-4,4-dimethyl-1-(methylamino)-1-oxopentan-2-yl]pyridine-2-carboxamide
Names & synonyms
CHEMBL3912526SCHEMBL14152828RUSMWNFLWLNSRI-KRWDZBQOSA-NBDBM210467US9290451, 182(S)-5-Cyclopropyl-6-(cyclopropylmethoxy)-N-(4,4-dimethyl-1-(methylamino)-1-oxopentan-2-yl)picolinamide
Database identifiers
- PubChem CID
- 71087953
- ChEMBL
CHEMBL3912526
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 80.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 537
Related reactions
2 records
Compound notes
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