Chemical ID: 5631714

CCCCCCC1CCC(CC1)C(=O)N2CCOCC2
Chemical ID:
5631714
Name [?]:
(4-hexylcyclohexyl)-morpholino-methanone
SMILES [?]:
CCCCCCC1CCC(CC1)C(=O)N2CCOCC2
InChi [?]:
InChI=1/C17H31NO2/c1-2-3-4-5-6-15-7-9-16(10-8-15)17(19)18-11-13-20-14-12-18/h15-16H,2-14H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,3,4,5,6,8,12,9,11,16,20,17,19,7,10,13,15,14,18/E:(7,8)(9,10)(11,12)(13,14)/rA:20nCCCCCCCCCCCCCONCCOCC/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;s10;s7s11;s10;d13;s13;s15;s16;s17;s18;s15s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H31NO2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.91422
Area:513.646
Solvation:-2.92692
Coulombic:-26.0759
Bond Count [?]
All:21
Single:20
Double:1
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:281.434
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.72
LogP (Chemaxon):3.31

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