Basic information
- Standard SMILES
Cc1nc(C(NC(=O)c2ccc(N3CC(F)(F)C3)c(OCC3CC3)n2)C2CC2)no1- InChIKey
DTUQXJLSDVPMLV-UHFFFAOYSA-N- Molecular formula
- C20H23F2N5O3
- Average molar mass
- 419.4 g/mol
Names & identifiers
- Preferred name
- 6-Cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyridine-2-carboxylic acid [cyclopropyl-(5-methyl-[1,2,4]oxadiazol-3-yl)-methyl]-amide
- IUPAC
- 6-(cyclopropylmethoxy)-N-[cyclopropyl-(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-5-(3,3-difluoroazetidin-1-yl)pyridine-2-carboxamide
Names & synonyms
6-Cyclopropylmethoxy-5-(3,3-difluoro-azetidin-1-yl)-pyridine-2-carboxylic acid [cyclopropyl-(5-methyl-[1,2,4]oxadiazol-3-yl)-methyl]-amideCHEMBL3960990SCHEMBL14226297BDBM210509US9290451, 221
Database identifiers
- PubChem CID
- 71105652
- ChEMBL
CHEMBL3960990
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 93.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 640
Related reactions
2 records
Compound notes
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