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Chemical ID: 5852501
Chemical ID:
5852501
Name [?]:
N-(2,3-dimethylphenyl)-N'-methyl-oxamide
SMILES [?]:
Cc1cccc(c1C)NC(=O)C(=O)NC
InChi [?]:
InChI=1/C11H14N2O2/c1-7-5-4-6-9(8(7)2)13-11(15)10(14)12-3/h4-6H,1-3H3,(H,12,14)(H,13,15)
InChi Info:
AuxInfo=1/1/N:1,8,15,4,3,5,2,7,6,12,10,14,9,13,11/rA:15nCCCCCCCCNCOCONC/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s9;d10;s10;d12;s12;s14;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H14N2O2 |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.10242 |
Area: | 389.821 |
Solvation: | -1.64311 |
Coulombic: | -46.7525 |
Bond Count [?]
All: | 15 |
Single: | 10 |
Double: | 5 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 206.241 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 1.12 |
LogP (Chemaxon): | 0.97 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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