Chemical ID: 6187438

CCN1CCc2c(cccc2OCC(C)C)C1=O
Chemical ID:
6187438
Name [?]:
2-ethyl-5-isobutoxy-3,4-dihydroisoquinolin-1-one
SMILES [?]:
CCN1CCc2c(cccc2OCC(C)C)C1=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H21NO2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.74968
Area:443.24
Solvation:-2.33131
Coulombic:-26.0675
Bond Count [?]
All:19
Single:15
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:247.333
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.83
LogP (Chemaxon):2.48

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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