Chemical ID: 5159873

Cc1cccc2c1nc3c(c2N4CCOCC4)CCCCC3
Chemical ID:
5159873
Name [?]:
None
SMILES [?]:
Cc1cccc2c1nc3c(c2N4CCOCC4)CCCCC3
InChi [?]:
InChI=1/C19H24N2O/c1-14-6-5-8-16-18(14)20-17-9-4-2-3-7-15(17)19(16)21-10-12-22-13-11-21/h5-6,8H,2-4,7,9-13H2,1H3
InChi Info:
AuxInfo=1/0/N:1,20,19,21,4,3,18,5,22,13,17,14,16,2,10,6,9,7,11,8,12,15/E:(10,11)(12,13)/rA:22nCCCCCCCNCCCNCCOCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;s9;s6d10;s11;s12;s13;s14;s15;s12s16;s10;s18;s19;s20;s9s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H24N2O
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.09594
Area:463.239
Solvation:-2.48504
Coulombic:-21.3051
Bond Count [?]
All:25
Single:20
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:296.407
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.65
LogP (Chemaxon):4.08

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Experimental Annotations

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Descriptor Annotations

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