Tert-butyl 9-[5-(methoxycarbonyl)pyridin-2-yl]-3,9-diazaspiro[5.5]undecane-3-carboxylate

HCID 57717452
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)c1ccc(N2CCC3(CCN(C(=O)OC(C)(C)C)CC3)CC2)nc1
InChIKey
XMGZHUQOFKNGMB-UHFFFAOYSA-N
Molecular formula
C21H31N3O4
Average molar mass
389.5 g/mol

Names & identifiers

Preferred name
Tert-butyl 9-[5-(methoxycarbonyl)pyridin-2-yl]-3,9-diazaspiro[5.5]undecane-3-carboxylate
IUPAC
tert-butyl 9-(5-methoxycarbonyl-2-pyridinyl)-3,9-diazaspiro[5.5]undecane-3-carboxylate

Names & synonyms

SCHEMBL1640835XMGZHUQOFKNGMB-UHFFFAOYSA-Ntert-butyl 9-[5-(methoxycarbonyl)pyridin-2-yl]-3,9-diazaspiro[5.5]undecane-3-carboxylate

Database identifiers

PubChem CID
57717452

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
72 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
28

Related reactions

9 records
New reaction record

Compound notes

Loading…