2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine

C184H224F7N59O14 — CID 157120698

IUPAC2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCC(C)c1nnc2cc(C(=O)N(C)C)ccn12.CC(C)c1nnc2cc(C(=O)O)ccn12.CC(C)c1nnc2cc(C(F)(F)F)ccn12.CC(C)c1nnc2cc(C(N)=O)ccn12.CC(C)c1nnc2ccc(C#N)cn12.CC(C)c1nnc2ccc(C(=O)CN)cn12.CC(C)c1nnc2ccc(C(=O)O)cn12.CC(C)c1nnc2ccc(C(F)(F)F)cn12.CC(C)c1nnc2ccc(C(N)=O)cn12.CC(C)c1nnc2ccc(F)cn12.CC(C)c1nnc2n1COCC2.CC(C)c1noc2ccccc12.CCOc1ccc2nnc(C(C)C)n2c1.CNC(=O)c1ccn2c(C(C)C)nnc2c1.CNCC(=O)c1ccc2nnc(C(C)C)n2c1.COc1ccc2nnc(C(C)C)n2c1.Cc1ccc2nnc(C(C)C)n2c1.Cc1ccn2c(C(C)C)nnc2c1
InChIInChI=1S/2C12H16N4O.2C11H14N4O.C11H15N3O.2C10H10F3N3.2C10H12N4O.C10H10N4.2C10H11N3O2.C10H13N3O.2C10H13N3.C10H11NO.C9H10FN3.C8H13N3O/c1-8(2)11-14-13-10-7-9(5-6-16(10)11)12(17)15(3)4;1-8(2)12-15-14-11-5-4-9(7-16(11)12)10(17)6-13-3;1-7(2)10-14-13-9-6-8(11(16)12-3)4-5-15(9)10;1-7(2)11-14-13-10-4-3-8(6-15(10)11)9(16)5-12;1-4-15-9-5-6-10-12-13-11(8(2)3)14(10)7-9;1-6(2)9-15-14-8-5-7(10(11,12)13)3-4-16(8)9;1-6(2)9-15-14-8-4-3-7(5-16(8)9)10(11,12)13;1-6(2)10-13-12-8-5-7(9(11)15)3-4-14(8)10;1-6(2)10-13-12-8-4-3-7(9(11)15)5-14(8)10;1-7(2)10-13-12-9-4-3-8(5-11)6-14(9)10;1-6(2)9-12-11-8-5-7(10(14)15)3-4-13(8)9;1-6(2)9-12-11-8-4-3-7(10(14)15)5-13(8)9;1-7(2)10-12-11-9-5-4-8(14-3)6-13(9)10;1-7(2)10-12-11-9-6-8(3)4-5-13(9)10;1-7(2)10-12-11-9-5-4-8(3)6-13(9)10;1-7(2)10-8-5-3-4-6-9(8)12-11-10;1-6(2)9-12-11-8-4-3-7(10)5-13(8)9;1-6(2)8-10-9-7-3-4-12-5-11(7)8/h5-8H,1-4H3;4-5,7-8,13H,6H2,1-3H3;4-7H,1-3H3,(H,12,16);3-4,6-7H,5,12H2,1-2H3;5-8H,4H2,1-3H3;2*3-6H,1-2H3;2*3-6H,1-2H3,(H2,11,15);3-4,6-7H,1-2H3;2*3-6H,1-2H3,(H,14,15);4-7H,1-3H3;2*4-7H,1-3H3;3-7H,1-2H3;3-6H,1-2H3;6H,3-5H2,1-2H3
InChIKeyAHXZARFMSVXVNP-UHFFFAOYSA-N
MW3619.20 g/mol
LogP31.80
Rot. Bonds32

About 2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine

2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 157120698) has the molecular formula C184H224F7N59O14 and a molecular weight of 3619.20 g/mol. Its IUPAC name is 2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID157120698
Molecular FormulaC184H224F7N59O14
Molecular Weight3619.20 g/mol
Exact Mass3616.85
IUPAC Name2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCC(C)c1nnc2cc(C(=O)N(C)C)ccn12.CC(C)c1nnc2cc(C(=O)O)ccn12.CC(C)c1nnc2cc(C(F)(F)F)ccn12.CC(C)c1nnc2cc(C(N)=O)ccn12.CC(C)c1nnc2ccc(C#N)cn12.CC(C)c1nnc2ccc(C(=O)CN)cn12.CC(C)c1nnc2ccc(C(=O)O)cn12.CC(C)c1nnc2ccc(C(F)(F)F)cn12.CC(C)c1nnc2ccc(C(N)=O)cn12.CC(C)c1nnc2ccc(F)cn12.CC(C)c1nnc2n1COCC2.CC(C)c1noc2ccccc12.CCOc1ccc2nnc(C(C)C)n2c1.CNC(=O)c1ccn2c(C(C)C)nnc2c1.CNCC(=O)c1ccc2nnc(C(C)C)n2c1.COc1ccc2nnc(C(C)C)n2c1.Cc1ccc2nnc(C(C)C)n2c1.Cc1ccn2c(C(C)C)nnc2c1
InChIInChI=1S/2C12H16N4O.2C11H14N4O.C11H15N3O.2C10H10F3N3.2C10H12N4O.C10H10N4.2C10H11N3O2.C10H13N3O.2C10H13N3.C10H11NO.C9H10FN3.C8H13N3O/c1-8(2)11-14-13-10-7-9(5-6-16(10)11)12(17)15(3)4;1-8(2)12-15-14-11-5-4-9(7-16(11)12)10(17)6-13-3;1-7(2)10-14-13-9-6-8(11(16)12-3)4-5-15(9)10;1-7(2)11-14-13-10-4-3-8(6-15(10)11)9(16)5-12;1-4-15-9-5-6-10-12-13-11(8(2)3)14(10)7-9;1-6(2)9-15-14-8-5-7(10(11,12)13)3-4-16(8)9;1-6(2)9-15-14-8-4-3-7(5-16(8)9)10(11,12)13;1-6(2)10-13-12-8-5-7(9(11)15)3-4-14(8)10;1-6(2)10-13-12-8-4-3-7(9(11)15)5-14(8)10;1-7(2)10-13-12-9-4-3-8(5-11)6-14(9)10;1-6(2)9-12-11-8-5-7(10(14)15)3-4-13(8)9;1-6(2)9-12-11-8-4-3-7(10(14)15)5-13(8)9;1-7(2)10-12-11-9-5-4-8(14-3)6-13(9)10;1-7(2)10-12-11-9-6-8(3)4-5-13(9)10;1-7(2)10-12-11-9-5-4-8(3)6-13(9)10;1-7(2)10-8-5-3-4-6-9(8)12-11-10;1-6(2)9-12-11-8-4-3-7(10)5-13(8)9;1-6(2)8-10-9-7-3-4-12-5-11(7)8/h5-8H,1-4H3;4-5,7-8,13H,6H2,1-3H3;4-7H,1-3H3,(H,12,16);3-4,6-7H,5,12H2,1-2H3;5-8H,4H2,1-3H3;2*3-6H,1-2H3;2*3-6H,1-2H3,(H2,11,15);3-4,6-7H,1-2H3;2*3-6H,1-2H3,(H,14,15);4-7H,1-3H3;2*4-7H,1-3H3;3-7H,1-2H3;3-6H,1-2H3;6H,3-5H2,1-2H3
InChIKeyAHXZARFMSVXVNP-UHFFFAOYSA-N
XLogP31.80
TPSA873.64 Ų
H-Bond Donors7
H-Bond Acceptors67
Rotatable Bonds32
Heavy Atoms264
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003619.20
LogP ≤ 531.80
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1067

Analyze 2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine (CID 157120698) is 2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine is CC(C)c1nnc2cc(C(=O)N(C)C)ccn12.CC(C)c1nnc2cc(C(=O)O)ccn12.CC(C)c1nnc2cc(C(F)(F)F)ccn12.CC(C)c1nnc2cc(C(N)=O)ccn12.CC(C)c1nnc2ccc(C#N)cn12.CC(C)c1nnc2ccc(C(=O)CN)cn12.CC(C)c1nnc2ccc(C(=O)O)cn12.CC(C)c1nnc2ccc(C(F)(F)F)cn12.CC(C)c1nnc2ccc(C(N)=O)cn12.CC(C)c1nnc2ccc(F)cn12.CC(C)c1nnc2n1COCC2.CC(C)c1noc2ccccc12.CCOc1ccc2nnc(C(C)C)n2c1.CNC(=O)c1ccn2c(C(C)C)nnc2c1.CNCC(=O)c1ccc2nnc(C(C)C)n2c1.COc1ccc2nnc(C(C)C)n2c1.Cc1ccc2nnc(C(C)C)n2c1.Cc1ccn2c(C(C)C)nnc2c1.
What is the InChIKey of 2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is AHXZARFMSVXVNP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H16N4O.2C11H14N4O.C11H15N3O.2C10H10F3N3.2C10H12N4O.C10H10N4.2C10H11N3O2.C10H13N3O.2C10H13N3.C10H11NO.C9H10FN3.C8H13N3O/c1-8(2)11-14-13-10-7-9(5-6-16(10)11)12(17)15(3)4;1-8(2)12-15-14-11-5-4-9(7-16(11)12)10(17)6-13-3;1-7(2)10-14-13-9-6-8(11(16)12-3)4-5-15(9)10;1-7(2)11-14-13-10-4-3-8(6-15(10)11)9(16)5-12;1-4-15-9-5-6-10-12-13-11(8(2)3)14(10)7-9;1-6(2)9-15-14-8-5-7(10(11,12)13)3-4-16(8)9;1-6(2)9-15-14-8-4-3-7(5-16(8)9)10(11,12)13;1-6(2)10-13-12-8-5-7(9(11)15)3-4-14(8)10;1-6(2)10-13-12-8-4-3-7(9(11)15)5-14(8)10;1-7(2)10-13-12-9-4-3-8(5-11)6-14(9)10;1-6(2)9-12-11-8-5-7(10(14)15)3-4-13(8)9;1-6(2)9-12-11-8-4-3-7(10(14)15)5-13(8)9;1-7(2)10-12-11-9-5-4-8(14-3)6-13(9)10;1-7(2)10-12-11-9-6-8(3)4-5-13(9)10;1-7(2)10-12-11-9-5-4-8(3)6-13(9)10;1-7(2)10-8-5-3-4-6-9(8)12-11-10;1-6(2)9-12-11-8-4-3-7(10)5-13(8)9;1-6(2)8-10-9-7-3-4-12-5-11(7)8/h5-8H,1-4H3;4-5,7-8,13H,6H2,1-3H3;4-7H,1-3H3,(H,12,16);3-4,6-7H,5,12H2,1-2H3;5-8H,4H2,1-3H3;2*3-6H,1-2H3;2*3-6H,1-2H3,(H2,11,15);3-4,6-7H,1-2H3;2*3-6H,1-2H3,(H,14,15);4-7H,1-3H3;2*4-7H,1-3H3;3-7H,1-2H3;3-6H,1-2H3;6H,3-5H2,1-2H3.
What are the key properties of 2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine?
2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 3619.20 g/mol, XLogP of 31.80, 32 rotatable bonds, 7 hydrogen bond donors, and 67 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;N,N-dimethyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;6-ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;2-(methylamino)-1-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanone;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;N-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 157120698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).