Chemical ID: 5845813

C1CCN(CC1)C(=O)CCC(=O)NC23CC4CC(C2)CC(C4)C3
Chemical ID:
5845813
Name [?]:
N-(1-adamantyl)-4-oxo-4-(1-piperidyl)butanamide
SMILES [?]:
C1CCN(CC1)C(=O)CCC(=O)NC23CC4CC(C2)CC(C4)C3
InChi [?]:
InChI=1/C19H30N2O2/c22-17(4-5-18(23)21-6-2-1-3-7-21)20-19-11-14-8-15(12-19)10-16(9-14)13-19/h14-16H,1-13H2,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,2,6,10,9,3,5,17,20,22,19,15,23,18,16,21,11,7,14,13,4,12,8/E:(2,3)(6,7)(8,9,10)(11,12,13)(14,15,16)/rA:23nCCCNCCCOCCCONCCCCCCCCCC/rB:s1;s2;s3;s4;s1s5;s4;d7;s7;s9;s10;d11;s11;s13;s14;s15;s16;s17;s14s18;s18;s20;s16s21;s14s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H30N2O2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.4817
Area:510.572
Solvation:-2.28263
Coulombic:-36.1376
Bond Count [?]
All:26
Single:24
Double:2
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:318.454
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.75
LogP (Chemaxon):1.07

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Descriptor Annotations

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