Basic information
- Standard SMILES
CCOC(=O)N1CCC(Nc2ccc(F)cc2N)CC1- InChIKey
UDJFFCMRXRNFOG-UHFFFAOYSA-N- Molecular formula
- C14H20FN3O2
- Average molar mass
- 281.33 g/mol
- Monoisotopic mass
- 281.15395505
Names & identifiers
- Preferred name
- 4-(2-Amino-4-fluoro-phenylamino)-piperidine-1-carboxylic acid ethyl ester
- IUPAC
- ethyl 4-(2-amino-4-fluoroanilino)piperidine-1-carboxylate
Names & synonyms
4-(2-amino-4-fluoro-phenylamino)-piperidine-1-carboxylic acid ethyl esterSCHEMBL4714159UDJFFCMRXRNFOG-UHFFFAOYSA-NAKOS009235651DB-3396091-ethoxycarbonyl-4-(2-amino-4-fluoroanilino)-piperidine4-(2-amino-4-fluoro-phenylamino)-piperidine 1-carboxylic acid ethyl ester107618-21-3
Database identifiers
- PubChem CID
- 13792172
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 67.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 322
Related reactions
4 records
Linked notes
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