Chemical ID: 5553517

Cc1ccc(cc1C)NC(=O)CCN(C)Cc2ccccc2
Chemical ID:
5553517
Name [?]:
3-(benzyl-methyl-amino)-N-(3,4-dimethylphenyl)-propanamide
SMILES [?]:
Cc1ccc(cc1C)NC(=O)CCN(C)Cc2ccccc2
InChi [?]:
InChI=1/C19H24N2O/c1-15-9-10-18(13-16(15)2)20-19(22)11-12-21(3)14-17-7-5-4-6-8-17/h4-10,13H,11-12,14H2,1-3H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,8,15,20,19,21,18,22,3,4,12,13,6,16,2,7,17,5,10,9,14,11/E:(5,6)(7,8)/rA:22cCCCCCCCCNCOCCNCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;d10;s10;s12;s13;s14;s14;s16;s17;d18;s19;d20;d17s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H24N2O
All Atoms:22
Heavy Atoms:22
Chiral Atoms:1
ZAP Information [?]
Total:10.792
Area:534.454
Solvation:-2.56933
Coulombic:-26.794
Bond Count [?]
All:23
Single:16
Double:7
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:296.407
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.54
LogP (Chemaxon):4.13

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Experimental Annotations

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Descriptor Annotations

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