Chemical ID: 7294938

Cc1ccc(cc1)NC(=O)c2ccccn2
Chemical ID:
7294938
Name [?]:
N-(p-tolyl)pyridine-2-carboxamide
SMILES [?]:
Cc1ccc(cc1)NC(=O)c2ccccn2
InChi [?]:
InChI=1/C13H12N2O/c1-10-5-7-11(8-6-10)15-13(16)12-4-2-3-9-14-12/h2-9H,1H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,13,14,12,3,7,4,6,15,2,5,11,9,16,8,10/E:(5,6)(7,8)/rA:16nCCCCCCCNCOCCCCCN/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s9;s11;d12;s13;d14;d11s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H12N2O
All Atoms:28
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.20541
Area:397.775
Solvation:-1.73896
Coulombic:-28.8932
Bond Count [?]
All:17
Single:10
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:212.247
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.27
LogP (Chemaxon):2.66

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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