(1-Chloro-5-methylisoquinolin-4-yl)(2-oxa-6-azaspiro[3.5]nonan-6-yl)methanone

HCID 86689583
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1cccc2c(Cl)ncc(C(=O)N3CCCC4(COC4)C3)c12
InChIKey
JKLVVFUUUBQRSX-UHFFFAOYSA-N
Molecular formula
C18H19ClN2O2
Average molar mass
330.8 g/mol
Monoisotopic mass
330.1135055

Names & identifiers

Preferred name
(1-Chloro-5-methylisoquinolin-4-yl)(2-oxa-6-azaspiro[3.5]nonan-6-yl)methanone
IUPAC
(1-chloro-5-methylisoquinolin-4-yl)-(2-oxa-8-azaspiro[3.5]nonan-8-yl)methanone

Names & synonyms

SCHEMBL12476985JKLVVFUUUBQRSX-UHFFFAOYSA-N(1-Chloro-5-methylisoquinolin-4-yl)(2-oxa-6-azaspiro[3.5]nonan-6-yl)methanone

Database identifiers

PubChem CID
86689583

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
42.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
23

Related reactions

1 records
New reaction record

Compound notes

Loading…