Chemical ID: 6187436

CCN1CCc2c(cccc2OC(C)C)C1=O
Chemical ID:
6187436
Name [?]:
2-ethyl-5-isopropoxy-3,4-dihydroisoquinolin-1-one
SMILES [?]:
CCN1CCc2c(cccc2OC(C)C)C1=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H19NO2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.02131
Area:414.303
Solvation:-2.33626
Coulombic:-25.4868
Bond Count [?]
All:18
Single:14
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:233.306
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.64
LogP (Chemaxon):2.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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