tert-butyl 3-[[5-(4-cyanooxan-4-yl)-2-methoxyphenyl]methylamino]-2-phenylpiperidine-1-carboxylate

HCID 178488762
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Basic information

Standard SMILES
COc1ccc(C2(C#N)CCOCC2)cc1CNC1CCCN(C(=O)OC(C)(C)C)C1c1ccccc1
InChIKey
HOLLKMTUDRVREC-UHFFFAOYSA-N
Molecular formula
C30H39N3O4
Average molar mass
505.6 g/mol
Monoisotopic mass
505.29405673

Names & identifiers

IUPAC
tert-butyl 3-[[5-(4-cyanooxan-4-yl)-2-methoxyphenyl]methylamino]-2-phenylpiperidine-1-carboxylate

Database identifiers

PubChem CID
19066449

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
83.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
37

Related reactions

1 records
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Linked notes

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