Chemical ID: 5895295

CC1CCN(CC1)C(=O)c2cc(ccc2N3CCCCC3)NC(=O)c4ccco4
Chemical ID:
5895295
Name [?]:
N-[3-[(4-methyl-1-piperidyl)carbonyl]-4-(1-piperidyl)phenyl]furan-2-carboxamide
SMILES [?]:
CC1CCN(CC1)C(=O)c2cc(ccc2N3CCCCC3)NC(=O)c4ccco4
InChi [?]:
InChI=1/C23H29N3O3/c1-17-9-13-26(14-10-17)23(28)19-16-18(24-22(27)21-6-5-15-29-21)7-8-20(19)25-11-3-2-4-12-25/h5-8,15-17H,2-4,9-14H2,1H3,(H,24,27)
InChi Info:
AuxInfo=1/1/N:1,19,18,20,27,26,13,14,3,7,17,21,4,6,28,11,2,12,10,15,25,23,8,22,16,5,24,9,29/E:(3,4)(9,10)(11,12)(13,14)/rA:29nCCCCNCCCOCCCCCCNCCCCCNCOCCCCO/rB:s1;s2;s3;s4;s5;s2s6;s5;d8;s8;s10;d11;s12;d13;d10s14;s15;s16;s17;s18;s19;s16s20;s12;s22;d23;s23;d25;s26;d27;s25s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H29N3O3
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:11.2845
Area:613.667
Solvation:-4.0572
Coulombic:-53.024
Bond Count [?]
All:32
Single:25
Double:7
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:395.495
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.68
LogP (Chemaxon):3.23

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Descriptor Annotations

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