Chemical ID: 3888484

Cc1cccc(c1C)Nc2c(cccn2)C(=O)O
Chemical ID:
3888484
Name [?]:
2-(2,3-dimethylphenyl)aminopyridine-3-carboxylic acid
SMILES [?]:
Cc1cccc(c1C)Nc2c(cccn2)C(=O)O
InChi [?]:
InChI=1/C14H14N2O2/c1-9-5-3-7-12(10(9)2)16-13-11(14(17)18)6-4-8-15-13/h3-8H,1-2H3,(H,15,16)(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,8,4,13,3,12,5,14,2,7,11,6,10,16,15,9,17,18/E:(17,18)/rA:18nCCCCCCCCNCCCCCNCOO/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s9;s10;d11;s12;d13;d10s14;s11;d16;s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H14N2O2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.06574
Area:411.491
Solvation:-2.22153
Coulombic:-44.6713
Bond Count [?]
All:19
Single:12
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:242.273
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:3.63
LogP (Chemaxon):1.88

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