Chemical ID: 7260701

Cc1ccc(cc1)CN(C)CC(=O)Nc2ccccc2C#N
Chemical ID:
7260701
Name [?]:
N-(2-cyanophenyl)-2-(methyl-(p-tolylmethyl)amino)-acetamide
SMILES [?]:
Cc1ccc(cc1)CN(C)CC(=O)Nc2ccccc2C#N
InChi [?]:
InChI=1/C18H19N3O/c1-14-7-9-15(10-8-14)12-21(2)13-18(22)20-17-6-4-3-5-16(17)11-19/h3-10H,12-13H2,1-2H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,10,18,17,19,16,3,7,4,6,21,8,11,2,5,20,15,12,22,14,9,13/E:(7,8)(9,10)/rA:22cCCCCCCCCNCCCONCCCCCCCN/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s9;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;t21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19N3O
All Atoms:41
Heavy Atoms:22
Chiral Atoms:1
ZAP Information [?]
Total:9.88553
Area:524.058
Solvation:-3.21591
Coulombic:-30.4159
Bond Count [?]
All:23
Single:15
Double:7
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:293.363
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.1
LogP (Chemaxon):3.3

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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