Chemical ID: 3638801

c1ccc(c(c1)N)NC(=O)c2cccnc2
Chemical ID:
3638801
Name [?]:
N-(2-aminophenyl)pyridine-3-carboxamide
SMILES [?]:
c1ccc(c(c1)N)NC(=O)c2cccnc2
InChi [?]:
InChI=1/C12H11N3O/c13-10-5-1-2-6-11(10)15-12(16)9-4-3-7-14-8-9/h1-8H,13H2,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,2,13,12,6,3,14,16,11,5,4,9,7,15,8,10/rA:16nCCCCCCNNCOCCCCNC/rB:s1;d2;s3;d4;d1s5;s5;s4;s8;d9;s9;s11;d12;s13;d14;d11s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H11N3O
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.34882
Area:390.173
Solvation:-2.40549
Coulombic:-42.7751
Bond Count [?]
All:17
Single:10
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:213.235
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:0.92
LogP (Chemaxon):1.01

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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