Chemical ID: 6036762

CCCCNC(=O)CCN(CC)C(=O)c1cc(oc1C)C
Chemical ID:
6036762
Name [?]:
N-[2-(butylcarbamoyl)ethyl]-N-ethyl-2,5-dimethyl-furan-3-carboxamide
SMILES [?]:
CCCCNC(=O)CCN(CC)C(=O)c1cc(oc1C)C
InChi [?]:
InChI=1/C16H26N2O3/c1-5-7-9-17-15(19)8-10-18(6-2)16(20)14-11-12(3)21-13(14)4/h11H,5-10H2,1-4H3,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,12,21,20,2,11,3,8,4,9,16,17,19,15,6,13,5,10,7,14,18/rA:21nCCCCNCOCCNCCCOCCCOCCC/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;s10;s11;s10;d13;s13;s15;d16;s17;d15s18;s19;s17;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H26N2O3
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:10.1156
Area:545.092
Solvation:-3.51174
Coulombic:-43.4939
Bond Count [?]
All:21
Single:17
Double:4
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:294.389
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.75
LogP (Chemaxon):1.06

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Descriptor Annotations

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