Chemical ID: 5784323

CCCCC(CC)CNC(=O)C(=O)NCc1ccccc1
Chemical ID:
5784323
Name [?]:
N'-benzyl-N-(2-ethylhexyl)oxamide
SMILES [?]:
CCCCC(CC)CNC(=O)C(=O)NCc1ccccc1
InChi [?]:
InChI=1/C17H26N2O2/c1-3-5-9-14(4-2)12-18-16(20)17(21)19-13-15-10-7-6-8-11-15/h6-8,10-11,14H,3-5,9,12-13H2,1-2H3,(H,18,20)(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,7,2,6,3,19,18,20,4,17,21,8,15,5,16,10,12,9,14,11,13/E:(7,8)(10,11)/rA:21cCCCCCCCCNCOCONCCCCCCC/rB:s1;s2;s3;s4;s5;s6;s5;s8;s9;d10;s10;d12;s12;s14;s15;s16;d17;s18;d19;d16s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H26N2O2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:1
ZAP Information [?]
Total:12.2703
Area:559.504
Solvation:-1.71726
Coulombic:-50.4774
Bond Count [?]
All:21
Single:16
Double:5
Rotors:11
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:290.401
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.96
LogP (Chemaxon):3.1

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Descriptor Annotations

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