Chemical ID: 3939481

Cc1cccc(c1)NC(=O)N2CCC(CC2)NC(=O)c3ccccc3C
Chemical ID:
3939481
Name [?]:
4-(2-methylbenzoyl)amino-N-(m-tolyl)piperidine-1-carboxamide
SMILES [?]:
Cc1cccc(c1)NC(=O)N2CCC(CC2)NC(=O)c3ccccc3C
InChi [?]:
InChI=1/C21H25N3O2/c1-15-6-5-8-18(14-15)23-21(26)24-12-10-17(11-13-24)22-20(25)19-9-4-3-7-16(19)2/h3-9,14,17H,10-13H2,1-2H3,(H,22,25)(H,23,26)
InChi Info:
AuxInfo=1/1/N:1,26,23,22,4,3,24,5,21,13,15,12,16,7,2,25,14,6,20,18,9,17,8,11,19,10/E:(10,11)(12,13)/rA:26nCCCCCCCNCONCCCCCNCOCCCCCCC/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;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H25N3O2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.6306
Area:578.372
Solvation:-2.82866
Coulombic:-53.5588
Bond Count [?]
All:28
Single:20
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:351.442
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:3.69
LogP (Chemaxon):3.29

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