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Chemical ID: 6036778
Chemical ID:
6036778
Name [?]:
N-ethyl-N-[2-(2-methoxyethylcarbamoyl)ethyl]-2,5-dimethyl-furan-3-carboxamide
SMILES [?]:
CCN(CCC(=O)NCCOC)C(=O)c1cc(oc1C)C
InChi [?]:
InChI=1/C15H24N2O4/c1-5-17(8-6-14(18)16-7-9-20-4)15(19)13-10-11(2)21-12(13)3/h10H,5-9H2,1-4H3,(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,21,20,12,2,5,9,4,10,16,17,19,15,6,13,8,3,7,14,11,18/rA:21nCCNCCCONCCOCCOCCCOCCC/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;s10;s11;s3;d13;s13;s15;d16;s17;d15s18;s19;s17;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H24N2O4 |
All Atoms: | 21 |
Heavy Atoms: | 21 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.28433 |
Area: | 533.127 |
Solvation: | -5.04385 |
Coulombic: | -50.1389 |
Bond Count [?]
All: | 21 |
Single: | 17 |
Double: | 4 |
Rotors: | 10 |
Chiral: | 0 |
Rigid Segments: | 7 |
Chemical Properties
Molecular Weight: | 296.362 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 5 |
XLogP: | 0.21 |
LogP (Chemaxon): | -0.31 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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