Chemical ID: 5292490

c1ccc2c(c1)ccc3c2c(cc(=O)o3)CN4CCCCCC4
Chemical ID:
5292490
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)ccc3c2c(cc(=O)o3)CN4CCCCCC4
InChi [?]:
InChI=1/C20H21NO2/c22-19-13-16(14-21-11-5-1-2-6-12-21)20-17-8-4-3-7-15(17)9-10-18(20)23-19/h3-4,7-10,13H,1-2,5-6,11-12,14H2
InChi Info:
AuxInfo=1/0/N:20,21,1,2,19,22,6,3,7,8,18,23,12,16,5,11,4,9,13,10,17,14,15/E:(1,2)(5,6)(11,12)/rA:23nCCCCCCCCCCCCCOOCNCCCCCC/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;d11;s12;d13;s9s13;s11;s16;s17;s18;s19;s20;s21;s17s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H21NO2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.58814
Area:471.028
Solvation:-2.18757
Coulombic:-25.9859
Bond Count [?]
All:26
Single:19
Double:7
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:307.386
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.93
LogP (Chemaxon):4.12

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Descriptor Annotations

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