Compound 243
  CheckMol                        TMF02:r0:m0
MF=C8H9NO2 MW=151.16
 11 11  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2877    0.7561   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5754    0.0236   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2759    2.2683   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8631    0.7797   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5636    3.0243   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0354    3.0243   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.1508    0.0473   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5518    4.5365   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0473    4.5365   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2405    5.2926   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6 02  0  1  0  0
  4  7 01  0  1  0  0
  5  8  1  0  0  0  0
  6  9 01  0  1  0  0
  7 10 02  0  1  0  0
  9 11 02  0  1  0  0
 10 11 01  0  1  0  0
M  END

2D Structure

Ethyl-2-Picolinate

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Chemical Name - Ethyl-2-Picolinate
Mol Weight - 151.164
Smiles - CCOC(c1ncccc1)=O

Property Name	Property Value
Mol Name	Ethyl-2-Picolinate
Molweight	151.164
Monoisotopic Mass	151.063329
Clogp	1.032
Clogs	-1.286
H Acceptors	3
Total Surface Area	125.79
Relative Psa	0.27037
Polar Surface Area	39.19
Druglikeness	-5.2228
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.72727
Molecular Flexibility	0.44787
Molecular Complexity	0.68024
Fragments	1
Non H Atoms	11
Non Ch Atoms	3
Electronegative Atoms	3
Rotatable Bonds	3
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	3
Aromatic Nitrogens	1
Smiles	CCOC(c1ncccc1)=O
InChIKey	InChI=1S/C8H9NO2/c1-2-11-8(10)7-5-3-4-6-9-7/h3-6H,2H2,1H3
InChI	FQYYIPZPELSLDK-UHFFFAOYSA-N

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1 — Ethyl-2-Picolinate | 2 — Ethyl-2-Picolinate