4-(2-Amino-4-fluoro-phenylamino)-piperidine-1-carboxylic acid ethyl ester

HCID 13792172

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

Related reactions

4 records

Linked notes

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