4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate

C64H60F2N22O12S — CID 159344910

IUPAC4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate
SMILESCOC(=O)c1ccn2nc(C)nc2c1.Cc1cnc(C)c(-c2cnn(C)c2C(=O)CO)n1.Cc1cnc(C)c(-c2cnn(C)c2C(=O)O)n1.Cn1ncc(-c2nc(C(F)F)cs2)c1C(=O)O.Cn1ncc(-c2ncccc2C#N)c1C(=O)CO.Cn1ncc(-c2ncccc2C#N)c1C(=O)O
InChIInChI=1S/C12H14N4O2.C12H10N4O2.C11H12N4O2.C11H8N4O2.C9H7F2N3O2S.C9H9N3O2/c1-7-4-13-8(2)11(15-7)9-5-14-16(3)12(9)10(18)6-17;1-16-12(10(18)7-17)9(6-15-16)11-8(5-13)3-2-4-14-11;1-6-4-12-7(2)9(14-6)8-5-13-15(3)10(8)11(16)17;1-15-10(11(16)17)8(6-14-15)9-7(5-12)3-2-4-13-9;1-14-6(9(15)16)4(2-12-14)8-13-5(3-17-8)7(10)11;1-6-10-8-5-7(9(13)14-2)3-4-12(8)11-6/h4-5,17H,6H2,1-3H3;2-4,6,17H,7H2,1H3;4-5H,1-3H3,(H,16,17);2-4,6H,1H3,(H,16,17);2-3,7H,1H3,(H,15,16);3-5H,1-2H3
InChIKeyLGPGCJLGASJSFW-UHFFFAOYSA-N
MW1399.39 g/mol
LogP6.45
Rot. Bonds14

About 4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate

4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate (PubChem CID 159344910) has the molecular formula C64H60F2N22O12S and a molecular weight of 1399.39 g/mol. Its IUPAC name is 4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate.

Molecular Properties

Compound Name4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate
PubChem CID159344910
Molecular FormulaC64H60F2N22O12S
Molecular Weight1399.39 g/mol
Exact Mass1398.44
IUPAC Name4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate
SMILESCOC(=O)c1ccn2nc(C)nc2c1.Cc1cnc(C)c(-c2cnn(C)c2C(=O)CO)n1.Cc1cnc(C)c(-c2cnn(C)c2C(=O)O)n1.Cn1ncc(-c2nc(C(F)F)cs2)c1C(=O)O.Cn1ncc(-c2ncccc2C#N)c1C(=O)CO.Cn1ncc(-c2ncccc2C#N)c1C(=O)O
InChIInChI=1S/C12H14N4O2.C12H10N4O2.C11H12N4O2.C11H8N4O2.C9H7F2N3O2S.C9H9N3O2/c1-7-4-13-8(2)11(15-7)9-5-14-16(3)12(9)10(18)6-17;1-16-12(10(18)7-17)9(6-15-16)11-8(5-13)3-2-4-14-11;1-6-4-12-7(2)9(14-6)8-5-13-15(3)10(8)11(16)17;1-15-10(11(16)17)8(6-14-15)9-7(5-12)3-2-4-13-9;1-14-6(9(15)16)4(2-12-14)8-13-5(3-17-8)7(10)11;1-6-10-8-5-7(9(13)14-2)3-4-12(8)11-6/h4-5,17H,6H2,1-3H3;2-4,6,17H,7H2,1H3;4-5H,1-3H3,(H,16,17);2-4,6H,1H3,(H,16,17);2-3,7H,1H3,(H,15,16);3-5H,1-2H3
InChIKeyLGPGCJLGASJSFW-UHFFFAOYSA-N
XLogP6.45
TPSA469.90 Ų
H-Bond Donors5
H-Bond Acceptors32
Rotatable Bonds14
Heavy Atoms101
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001399.39
LogP ≤ 56.45
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1032

Analyze 4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate with MolForge

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Related Compounds

2-bromo-6-fluoro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;tert-butyl 2-(2-bromo-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;tert-butyl 2-[6-fluoro-2-[(2R)-2-(trifluoromethyl)pyrrolidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-7-yl]acetate;4-[4-(difluoromethyl)-5-methyl-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;methyl 2-amino-6-fluoro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;methyl 2-bromo-6-fluoro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;1-methyl-4-(4-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxylic acid
CID 157447273
Sodium;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(4,6-dimethyl-2-pyridinyl)-1-methylpyrazole-5-carboxylate;2-hydroxy-1-[1-methyl-4-(6-methylpyrazin-2-yl)pyrazol-5-yl]ethanone;1-methyl-4-(6-methylpyrazin-2-yl)pyrazole-5-carboxylic acid;1-methyl-4-[6-(trifluoromethyl)-2-pyridinyl]pyrazole-5-carboxylic acid
CID 159752123
Disodium;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(4,6-dimethyl-2-pyridinyl)-1-methylpyrazole-5-carboxylate;4-(5-fluoro-2-pyridinyl)-1-methylpyrazole-5-carboxylate;2-hydroxy-1-[1-methyl-4-(6-methylpyrazin-2-yl)pyrazol-5-yl]ethanone;1-methyl-4-(6-methylpyrazin-2-yl)pyrazole-5-carboxylic acid;1-methyl-4-[6-(trifluoromethyl)-2-pyridinyl]pyrazole-5-carboxylic acid
CID 159779400
Sodium;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(4,6-dimethyl-2-pyridinyl)-1-methylpyrazole-5-carboxylate;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;2-hydroxy-1-[1-methyl-4-(6-methylpyrazin-2-yl)pyrazol-5-yl]ethanone;1-methyl-4-(6-methylpyrazin-2-yl)pyrazole-5-carboxylic acid;1-methyl-4-[6-(trifluoromethyl)-2-pyridinyl]pyrazole-5-carboxylic acid
CID 159847332
Tert-butyl 2-(3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)acetate;3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-amine;3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxylic acid;2-hydroxy-1-[1-methyl-4-(1,3-thiazol-4-yl)pyrazol-5-yl]ethanone;methyl 3-fluoro-2-phenylimidazo[1,2-a]pyridine-7-carboxylate;methyl 3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxylate;methyl 2-[(2,2,2-trifluoro-1-phenylethylidene)amino]pyridine-4-carboxylate;hydrochloride
CID 160099718
Sodium;4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;4-(4,6-dimethyl-2-pyridinyl)-1-methylpyrazole-5-carboxylate;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;1-methyl-4-[6-(trifluoromethyl)-2-pyridinyl]pyrazole-5-carboxylic acid
CID 161305041
2-bromo-6-fluoro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;tert-butyl 2-(2-bromo-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;tert-butyl 2-[6-fluoro-2-[(2R)-2-(trifluoromethyl)pyrrolidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-7-yl]acetate;2-[(3R)-3-fluoropyrrolidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-7-amine;6-fluoro-2-[(2R)-2-(trifluoromethyl)pyrrolidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-7-amine;methyl 2-amino-6-fluoro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;methyl 2-bromo-6-fluoro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;1-methyl-4-(4-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxylic acid
CID 162063397
2-bromo-6-fluoro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;tert-butyl 2-(2-bromo-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;tert-butyl 2-[6-fluoro-2-[(2R)-2-(trifluoromethyl)pyrrolidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-7-yl]acetate;6-fluoro-2-[(2R)-2-(trifluoromethyl)pyrrolidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-7-amine;methyl 2-amino-6-fluoro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;methyl 2-bromo-6-fluoro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;1-methyl-4-(4-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxylic acid
CID 162130927
1-[4-(4,6-dimethyl-2-pyridinyl)-1-methylpyrazol-5-yl]-2-[2-[(3S)-3-fluoropyrrolidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-7-yl]ethanone;2-[2-[(3S)-3-fluoropyrrolidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-7-yl]-1-[4-(4-methoxy-2-pyridinyl)-1-methylpyrazol-5-yl]ethanone;2-[2-[(3S)-3-fluoropyrrolidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-7-yl]-1-[1-methyl-4-(6-methylpyrazin-2-yl)pyrazol-5-yl]ethanone;2-[2-[(3S)-3-fluoropyrrolidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-7-yl]-1-[1-methyl-4-(6-methyl-2-pyridinyl)pyrazol-5-yl]ethanone;2-[2-[(3S)-3-fluoropyrrolidin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-7-yl]-1-[1-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyrazol-5-yl]ethanone
CID 162199464
Sodium;tert-butyl 2-(3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)acetate;3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-amine;3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxylic acid;2-hydroxy-1-[1-methyl-4-(1,3-thiazol-2-yl)pyrazol-5-yl]ethanone;2-hydroxy-1-[1-methyl-4-(1,3-thiazol-4-yl)pyrazol-5-yl]ethanone;1-methyl-4-(4-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxylate;hydrochloride
CID 157092533
2-Bromo-6-fluoro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid;tert-butyl 2-(2-bromo-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-7-yl)acetate;4-[4-(difluoromethyl)-5-methyl-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(4,6-dimethyl-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;methyl 2-amino-6-fluoro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;methyl 2-bromo-6-fluoro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate;1-methyl-4-(4-methyl-1,3-thiazol-2-yl)pyrazole-5-carboxylic acid
CID 157186907
Tert-butyl 2-(3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)acetate;3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-amine;3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxylic acid;2-hydroxy-1-[1-methyl-4-(1,3-thiazol-2-yl)pyrazol-5-yl]ethanone;2-hydroxy-1-[1-methyl-4-(1,3-thiazol-4-yl)pyrazol-5-yl]ethanone;methyl 3-fluoro-2-phenylimidazo[1,2-a]pyridine-7-carboxylate;methyl 3-fluoro-2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxylate;hydrochloride
CID 157552611

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate?
The IUPAC name of 4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate (CID 159344910) is 4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate.
What is the SMILES notation for 4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate?
The canonical SMILES for 4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate is COC(=O)c1ccn2nc(C)nc2c1.Cc1cnc(C)c(-c2cnn(C)c2C(=O)CO)n1.Cc1cnc(C)c(-c2cnn(C)c2C(=O)O)n1.Cn1ncc(-c2nc(C(F)F)cs2)c1C(=O)O.Cn1ncc(-c2ncccc2C#N)c1C(=O)CO.Cn1ncc(-c2ncccc2C#N)c1C(=O)O.
What is the InChIKey of 4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate?
The InChIKey is LGPGCJLGASJSFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2.C12H10N4O2.C11H12N4O2.C11H8N4O2.C9H7F2N3O2S.C9H9N3O2/c1-7-4-13-8(2)11(15-7)9-5-14-16(3)12(9)10(18)6-17;1-16-12(10(18)7-17)9(6-15-16)11-8(5-13)3-2-4-14-11;1-6-4-12-7(2)9(14-6)8-5-13-15(3)10(8)11(16)17;1-15-10(11(16)17)8(6-14-15)9-7(5-12)3-2-4-13-9;1-14-6(9(15)16)4(2-12-14)8-13-5(3-17-8)7(10)11;1-6-10-8-5-7(9(13)14-2)3-4-12(8)11-6/h4-5,17H,6H2,1-3H3;2-4,6,17H,7H2,1H3;4-5H,1-3H3,(H,16,17);2-4,6H,1H3,(H,16,17);2-3,7H,1H3,(H,15,16);3-5H,1-2H3.
What are the key properties of 4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate?
4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate has a molecular weight of 1399.39 g/mol, XLogP of 6.45, 14 rotatable bonds, 5 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyano-2-pyridinyl)-1-methylpyrazole-5-carboxylic acid;4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazole-5-carboxylic acid;4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazole-5-carboxylic acid;1-[4-(3,6-dimethylpyrazin-2-yl)-1-methylpyrazol-5-yl]-2-hydroxyethanone;2-[5-(2-hydroxyacetyl)-1-methylpyrazol-4-yl]pyridine-3-carbonitrile;methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate is sourced from PubChem (CID 159344910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).