Chemical ID: 3967927

CCC(CC)OC1C=C(CC(C1NC(=O)C)N)C(=O)OCC
Chemical ID:
3967927
Name [?]:
ethyl 4-acetamido-5-amino-3-(1-ethylpropoxy)cyclohexene-1-carboxylate
SMILES [?]:
CCC(CC)OC1C=C(CC(C1NC(=O)C)N)C(=O)OCC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H28N2O4
All Atoms:22
Heavy Atoms:22
Chiral Atoms:3
ZAP Information [?]
Total:9.14313
Area:514.031
Solvation:-3.70766
Coulombic:-60.2182
Bond Count [?]
All:22
Single:19
Double:3
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:312.405
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:1.01
LogP (Chemaxon):0.53

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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