1,1-Dimethylethyl 4-[(3-cyanophenyl)amino]-1-piperidinecarboxylate

HCID 25223796

Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCC(Nc2cccc(C#N)c2)CC1
InChIKey
CZWWGGWJPUUXTN-UHFFFAOYSA-N
Molecular formula
C17H23N3O2
Average molar mass
301.4 g/mol

Names & identifiers

Preferred name
1,1-Dimethylethyl 4-[(3-cyanophenyl)amino]-1-piperidinecarboxylate
IUPAC
tert-butyl 4-(3-cyanoanilino)piperidine-1-carboxylate

Names & synonyms

SCHEMBL377671CZWWGGWJPUUXTN-UHFFFAOYSA-N1,1-Dimethylethyl 4-[(3-cyanophenyl)amino]-1-piperidinecarboxylate4-(3-Cyano-phenylamino)-piperidine-1-carboxylic acid tert-butyl ester

Database identifiers

PubChem CID
25223796

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
65.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
22

Related reactions

15 records

Linked notes

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