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Chemical ID: 4479921
Chemical ID:
4479921
Name [?]:
N'-(3-ethoxypropyl)-N-sec-butyl-oxamide
SMILES [?]:
CCC(C)NC(=O)C(=O)NCCCOCC
InChi [?]:
InChI=1/C11H22N2O3/c1-4-9(3)13-11(15)10(14)12-7-6-8-16-5-2/h9H,4-8H2,1-3H3,(H,12,14)(H,13,15)
InChi Info:
AuxInfo=1/1/N:1,16,4,2,15,12,11,13,3,8,6,10,5,9,7,14/rA:16cCCCCNCOCONCCCOCC/rB:s1;s2;s3;s3;s5;d6;s6;d8;s8;s10;s11;s12;s13;s14;s15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H22N2O3 |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 8.7396 |
Area: | 469.487 |
Solvation: | -2.99758 |
Coulombic: | -54.7979 |
Bond Count [?]
All: | 15 |
Single: | 13 |
Double: | 2 |
Rotors: | 10 |
Chiral: | 0 |
Rigid Segments: | 7 |
Chemical Properties
Molecular Weight: | 230.304 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 5 |
XLogP: | 0.72 |
LogP (Chemaxon): | -0.02 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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