Chemical ID: 3939526

c1ccc(cc1)C(=O)NC2CCN(CC2)C(=O)Nc3ccccc3F
Chemical ID:
3939526
Name [?]:
4-benzamido-N,N-bis(4-benzamido-6-piperidyl)-piperidine-1-carboxamide
SMILES [?]:
c1ccc(cc1)C(=O)NC2CCN(CC2)C(=O)Nc3ccccc3F
InChi [?]:
InChI=1/C19H20FN3O2/c20-16-8-4-5-9-17(16)22-19(25)23-12-10-15(11-13-23)21-18(24)14-6-2-1-3-7-14/h1-9,15H,10-13H2,(H,21,24)(H,22,25)
InChi Info:
AuxInfo=1/1/N:1,2,6,22,21,3,5,23,20,11,15,12,14,4,10,24,19,7,16,25,9,18,13,8,17/E:(2,3)(6,7)(10,11)(12,13)/rA:25nCCCCCCCONCCCNCCCONCCCCCCF/rB:s1;d2;s3;d4;d1s5;s4;d7;s7;s9;s10;s11;s12;s13;s10s14;s13;d16;s16;s18;s19;d20;s21;d22;d19s23;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H20FN3O2
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.5192
Area:547.762
Solvation:-3.17483
Coulombic:-58.1875
Bond Count [?]
All:27
Single:19
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:341.38
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:2.98
LogP (Chemaxon):1.85

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Descriptor Annotations

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