Chemical ID: 5113312

COC(=O)CC(c1ccc2c(c1)OCO2)N3CCCCC3
Chemical ID:
5113312
Name [?]:
methyl 3-benzo[1,3]dioxol-5-yl-3-(1-piperidyl)propanoate
SMILES [?]:
COC(=O)CC(c1ccc2c(c1)OCO2)N3CCCCC3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H21NO4
All Atoms:21
Heavy Atoms:21
Chiral Atoms:1
ZAP Information [?]
Total:8.28545
Area:474.6
Solvation:-3.57954
Coulombic:-39.8192
Bond Count [?]
All:23
Single:19
Double:4
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:291.342
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:2.36
LogP (Chemaxon):2.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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