4-(4-Pyrimidin-2-yl-phenylamino)-piperidine-1-carboxylic acid tert-butyl ester

HCID 58985153
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Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCC(Nc2ccc(-c3ncccn3)cc2)CC1
InChIKey
TZIJADMKJILSGF-UHFFFAOYSA-N
Molecular formula
C20H26N4O2
Average molar mass
354.4 g/mol

Names & identifiers

Preferred name
4-(4-Pyrimidin-2-yl-phenylamino)-piperidine-1-carboxylic acid tert-butyl ester
IUPAC
tert-butyl 4-(4-pyrimidin-2-ylanilino)piperidine-1-carboxylate

Names & synonyms

SCHEMBL2874966TZIJADMKJILSGF-UHFFFAOYSA-N4-(4-Pyrimidin-2-yl-phenylamino)-piperidine-1-carboxylic acid tert-butyl ester

Database identifiers

PubChem CID
58985153

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
67.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
26

Related reactions

3 records
New reaction record

Compound notes

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