Basic information
- Standard SMILES
COc1cncc(-c2cc(F)c(C(=O)N3CCCC3CN3CCCC3)c(F)c2)c1- InChIKey
LNWHCAWQRWNDKO-UHFFFAOYSA-N- Molecular formula
- C22H25F2N3O2
- Average molar mass
- 401.4 g/mol
Names & identifiers
- Preferred name
- [2,6-Difluoro-4-(5-methoxy-3-pyridinyl)phenyl]-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone
- IUPAC
- [2,6-difluoro-4-(5-methoxy-3-pyridinyl)phenyl]-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone
Names & synonyms
SCHEMBL2349249
Database identifiers
- PubChem CID
- 57980071
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 45.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 548
Related reactions
1 records
Linked notes
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