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Chemical ID: 6032155
Chemical ID:
6032155
Name [?]:
N-isobutyl-N-[2-(propylcarbamoyl)ethyl]furan-3-carboxamide
SMILES [?]:
CCCNC(=O)CCN(CC(C)C)C(=O)c1ccoc1
InChi [?]:
InChI=1/C15H24N2O3/c1-4-7-16-14(18)5-8-17(10-12(2)3)15(19)13-6-9-20-11-13/h6,9,11-12H,4-5,7-8,10H2,1-3H3,(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,12,13,2,7,17,3,8,18,10,20,11,16,5,14,4,9,6,15,19/E:(2,3)/rA:20nCCCNCOCCNCCCCCOCCCOC/rB:s1;s2;s3;s4;d5;s5;s7;s8;s9;s10;s11;s11;s9;d14;s14;s16;d17;s18;d16s19;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H24N2O3 |
All Atoms: | 20 |
Heavy Atoms: | 20 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.24852 |
Area: | 503.859 |
Solvation: | -3.34796 |
Coulombic: | -43.7643 |
Bond Count [?]
All: | 20 |
Single: | 16 |
Double: | 4 |
Rotors: | 10 |
Chiral: | 0 |
Rigid Segments: | 7 |
Chemical Properties
Molecular Weight: | 280.363 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 4 |
XLogP: | 1.36 |
LogP (Chemaxon): | 1.5 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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