Chemical ID: 4408040

Cc1ccccc1C(=O)N2CCC(CC2)C(=O)Nc3ccccc3Cl
Chemical ID:
4408040
Name [?]:
N-(2-chlorophenyl)-1-(2-methylbenzoyl)-piperidine-4-carboxamide
SMILES [?]:
Cc1ccccc1C(=O)N2CCC(CC2)C(=O)Nc3ccccc3Cl
InChi [?]:
InChI=1/C20H21ClN2O2/c1-14-6-2-3-7-16(14)20(25)23-12-10-15(11-13-23)19(24)22-18-9-5-4-8-17(18)21/h2-9,15H,10-13H2,1H3,(H,22,24)
InChi Info:
AuxInfo=1/1/N:1,4,5,22,21,3,6,23,20,12,14,11,15,2,13,7,24,19,16,8,25,18,10,17,9/E:(10,11)(12,13)/rA:25nCCCCCCCCONCCCCCCONCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;s8;s10;s11;s12;s13;s10s14;s13;d16;s16;s18;s19;d20;s21;d22;d19s23;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H21ClN2O2
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:11.2388
Area:560.346
Solvation:-2.76979
Coulombic:-40.0399
Bond Count [?]
All:27
Single:19
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:356.846
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.9
LogP (Chemaxon):3.12

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