4-(Azetidin-1-ylmethyl)piperidine-1-carboxylic acid [4-(4-amino-2-fluorophenoxy)pyridin-2-yl]amide
Basic information
- Standard SMILES
Nc1ccc(Oc2ccnc(NC(=O)N3CCC(CN4CCC4)CC3)c2)c(F)c1- InChIKey
GTUAZLQXPWCFAZ-UHFFFAOYSA-N- Molecular formula
- C21H26FN5O2
- Average molar mass
- 399.5 g/mol
- Monoisotopic mass
- 399.20705325
Names & identifiers
- Preferred name
- 4-(Azetidin-1-ylmethyl)piperidine-1-carboxylic acid [4-(4-amino-2-fluorophenoxy)pyridin-2-yl]amide
- IUPAC
- N-[4-(4-amino-2-fluorophenoxy)-2-pyridinyl]-4-(azetidin-1-ylmethyl)piperidine-1-carboxamide
Names & synonyms
GTUAZLQXPWCFAZ-UHFFFAOYSA-N4-(azetidin-1-ylmethyl)piperidine-1-carboxylic acid [4-(4-amino-2-fluorophenoxy)pyridin-2-yl]amide
Database identifiers
- PubChem CID
- 86602176
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 83.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 541
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Related reactions
6 records
Compound notes
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