(+/-)-6,7-Dimethoxy-2-{[1-(tert-butyloxycarbonyl)-3-piperidyl]carbonyl}-1,2,3,4-tetrahydroisoquinoline

HCID 18520105

Basic information

Standard SMILES
COc1cc2c(cc1OC)CN(C(=O)C1CCCN(C(=O)OC(C)(C)C)C1)CC2
InChIKey
LPTNUCSJSXOWRA-UHFFFAOYSA-N
Molecular formula
C22H32N2O5
Average molar mass
404.5 g/mol

Names & identifiers

Preferred name
(+/-)-6,7-Dimethoxy-2-{[1-(tert-butyloxycarbonyl)-3-piperidyl]carbonyl}-1,2,3,4-tetrahydroisoquinoline
IUPAC
tert-butyl 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)piperidine-1-carboxylate

Names & synonyms

SCHEMBL6590781LPTNUCSJSXOWRA-UHFFFAOYSA-NAKOS033356029Z145200432(+/-)-6,7-dimethoxy-2-{[1-(tert-butyloxycarbonyl)-3-piperidyl]carbonyl}-1,2,3,4-tetrahydroisoquinoline

Database identifiers

PubChem CID
18520105

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
68.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
29

Related reactions

4 records

Linked notes

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