Chemical ID: 3939520

Cc1cc(cc(c1)NC(=O)N2CCC(CC2)NC(=O)c3ccccc3OC)C
Chemical ID:
3939520
Name [?]:
N-(3,5-dimethylphenyl)-4-(2-methoxybenzoyl)amino-piperidine-1-carboxamide
SMILES [?]:
Cc1cc(cc(c1)NC(=O)N2CCC(CC2)NC(=O)c3ccccc3OC)C
InChi [?]:
InChI=1/C22H27N3O3/c1-15-12-16(2)14-18(13-15)24-22(27)25-10-8-17(9-11-25)23-21(26)19-6-4-5-7-20(19)28-3/h4-7,12-14,17H,8-11H2,1-3H3,(H,23,26)(H,24,27)
InChi Info:
AuxInfo=1/1/N:1,28,27,22,23,21,24,13,15,12,16,3,7,5,2,4,14,6,20,25,18,9,17,8,11,19,10,26/E:(1,2)(8,9)(10,11)(13,14)(15,16)/rA:28nCCCCCCCNCONCCCCCNCOCCCCCCOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;s12;s13;s14;s11s15;s14;s17;d18;s18;s20;d21;s22;d23;d20s24;s25;s26;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H27N3O3
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.4551
Area:616.968
Solvation:-4.96913
Coulombic:-58.7606
Bond Count [?]
All:30
Single:22
Double:8
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:381.468
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.61
LogP (Chemaxon):3.04

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Descriptor Annotations

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