Chemical ID: 6032619

Cc1c(cco1)C(=O)N2CCCC(C2)C(=O)NCc3ccco3
Chemical ID:
6032619
Name [?]:
N-(2-furylmethyl)-1-[(2-methyl-3-furyl)carbonyl]piperidine-3-carboxamide
SMILES [?]:
Cc1c(cco1)C(=O)N2CCCC(C2)C(=O)NCc3ccco3
InChi [?]:
InChI=1/C17H20N2O4/c1-12-15(6-9-22-12)17(21)19-7-2-4-13(11-19)16(20)18-10-14-5-3-8-23-14/h3,5-6,8-9,13H,2,4,7,10-11H2,1H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,11,21,12,20,4,10,22,5,18,14,2,13,19,3,15,7,17,9,16,8,6,23/rA:23cCCCCCOCONCCCCCCONCCCCCO/rB:s1;d2;s3;d4;s2s5;s3;d7;s7;s9;s10;s11;s12;s9s13;s13;d15;s15;s17;s18;d19;s20;d21;s19s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H20N2O4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:8.40058
Area:527.97
Solvation:-4.79867
Coulombic:-49.8492
Bond Count [?]
All:25
Single:19
Double:6
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:316.352
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:0.52
LogP (Chemaxon):0.69

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Descriptor Annotations

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