Chemical ID: 4888723

c1cc(ccc1C(=O)N2CCCC(C2)C(=O)N3CCCCC3)Cl
Chemical ID:
4888723
Name [?]:
(4-chlorophenyl)-[3-(1-piperidylcarbonyl)-1-piperidyl]-methanone
SMILES [?]:
c1cc(ccc1C(=O)N2CCCC(C2)C(=O)N3CCCCC3)Cl
InChi [?]:
InChI=1/C18H23ClN2O2/c19-16-8-6-14(7-9-16)17(22)21-12-4-5-15(13-21)18(23)20-10-2-1-3-11-20/h6-9,15H,1-5,10-13H2
InChi Info:
AuxInfo=1/0/N:20,19,21,11,12,1,5,2,4,18,22,10,14,6,13,3,7,15,23,17,9,8,16/E:(2,3)(6,7)(8,9)(10,11)/rA:23cCCCCCCCONCCCCCCONCCCCCCl/rB:s1;d2;s3;d4;d1s5;s6;d7;s7;s9;s10;s11;s12;s9s13;s13;d15;s15;s17;s18;s19;s20;s17s21;s3;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H23ClN2O2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:10.5677
Area:527.965
Solvation:-2.63141
Coulombic:-34.7021
Bond Count [?]
All:25
Single:20
Double:5
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:334.84
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:2.9
LogP (Chemaxon):2.26

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Descriptor Annotations

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