Chemical ID: 4391530

CCc1ccc(cc1)OCC(=O)N2CCOCC2
Chemical ID:
4391530
Name [?]:
2-(4-ethylphenoxy)-1-morpholino-ethanone
SMILES [?]:
CCc1ccc(cc1)OCC(=O)N2CCOCC2
InChi [?]:
InChI=1/C14H19NO3/c1-2-12-3-5-13(6-4-12)18-11-14(16)15-7-9-17-10-8-15/h3-6H,2,7-11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,4,8,5,7,14,18,15,17,10,3,6,11,13,12,16,9/E:(3,4)(5,6)(7,8)(9,10)/rA:18nCCCCCCCCOCCONCCOCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;s10;d11;s11;s13;s14;s15;s16;s13s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H19NO3
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:6.07347
Area:449.535
Solvation:-5.1649
Coulombic:-31.8977
Bond Count [?]
All:19
Single:15
Double:4
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:249.306
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:1.75
LogP (Chemaxon):1.48

Name Annotations

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Descriptor Annotations

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