1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one

C122H111F3N32O7 — CID 158454656

IUPAC1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one
SMILESCC(C)c1cc(CC(=O)Cc2ccc(-c3cccn4nnc(N)c34)cc2)[nH]n1.CCCCC(=O)Cc1ccc(-c2cccn3nnc(N)c23)cc1.Cc1cc(CC(=O)Cc2ccc(-c3cccn4nnc(N)c34)cc2)no1.Cc1ccc(CC(=O)Cc2ccc(-c3cccn4nnc(N)c34)cc2)cc1C(F)(F)F.N#Cc1cn[nH]c1CC(=O)Cc1ccc(-c2cccn3nnc(N)c23)cc1.Nc1nnn2cccc(-c3ccc(CC(=O)Cc4[nH]nc5ccccc45)cc3)c12
InChIInChI=1S/C23H19F3N4O.C22H18N6O.C21H22N6O.C19H15N7O.C19H17N5O2.C18H20N4O/c1-14-4-5-16(13-20(14)23(24,25)26)12-18(31)11-15-6-8-17(9-7-15)19-3-2-10-30-21(19)22(27)28-29-30;23-22-21-17(5-3-11-28(21)27-26-22)15-9-7-14(8-10-15)12-16(29)13-20-18-4-1-2-6-19(18)24-25-20;1-13(2)19-12-16(23-24-19)11-17(28)10-14-5-7-15(8-6-14)18-4-3-9-27-20(18)21(22)25-26-27;20-10-14-11-22-23-17(14)9-15(27)8-12-3-5-13(6-4-12)16-2-1-7-26-18(16)19(21)24-25-26;1-12-9-15(22-26-12)11-16(25)10-13-4-6-14(7-5-13)17-3-2-8-24-18(17)19(20)21-23-24;1-2-3-5-15(23)12-13-7-9-14(10-8-13)16-6-4-11-22-17(16)18(19)20-21-22/h2-10,13H,11-12,27H2,1H3;1-11H,12-13,23H2,(H,24,25);3-9,12-13H,10-11,22H2,1-2H3,(H,23,24);1-7,11H,8-9,21H2,(H,22,23);2-9H,10-11,20H2,1H3;4,6-11H,2-3,5,12,19H2,1H3
InChIKeyHEKPAERHCQDICZ-UHFFFAOYSA-N
MW2194.44 g/mol
LogP18.89
Rot. Bonds32

About 1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one

1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one (PubChem CID 158454656) has the molecular formula C122H111F3N32O7 and a molecular weight of 2194.44 g/mol. Its IUPAC name is 1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one.

Molecular Properties

Compound Name1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one
PubChem CID158454656
Molecular FormulaC122H111F3N32O7
Molecular Weight2194.44 g/mol
Exact Mass2192.93
IUPAC Name1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one
SMILESCC(C)c1cc(CC(=O)Cc2ccc(-c3cccn4nnc(N)c34)cc2)[nH]n1.CCCCC(=O)Cc1ccc(-c2cccn3nnc(N)c23)cc1.Cc1cc(CC(=O)Cc2ccc(-c3cccn4nnc(N)c34)cc2)no1.Cc1ccc(CC(=O)Cc2ccc(-c3cccn4nnc(N)c34)cc2)cc1C(F)(F)F.N#Cc1cn[nH]c1CC(=O)Cc1ccc(-c2cccn3nnc(N)c23)cc1.Nc1nnn2cccc(-c3ccc(CC(=O)Cc4[nH]nc5ccccc45)cc3)c12
InChIInChI=1S/C23H19F3N4O.C22H18N6O.C21H22N6O.C19H15N7O.C19H17N5O2.C18H20N4O/c1-14-4-5-16(13-20(14)23(24,25)26)12-18(31)11-15-6-8-17(9-7-15)19-3-2-10-30-21(19)22(27)28-29-30;23-22-21-17(5-3-11-28(21)27-26-22)15-9-7-14(8-10-15)12-16(29)13-20-18-4-1-2-6-19(18)24-25-20;1-13(2)19-12-16(23-24-19)11-17(28)10-14-5-7-15(8-6-14)18-4-3-9-27-20(18)21(22)25-26-27;20-10-14-11-22-23-17(14)9-15(27)8-12-3-5-13(6-4-12)16-2-1-7-26-18(16)19(21)24-25-26;1-12-9-15(22-26-12)11-16(25)10-13-4-6-14(7-5-13)17-3-2-8-24-18(17)19(20)21-23-24;1-2-3-5-15(23)12-13-7-9-14(10-8-13)16-6-4-11-22-17(16)18(19)20-21-22/h2-10,13H,11-12,27H2,1H3;1-11H,12-13,23H2,(H,24,25);3-9,12-13H,10-11,22H2,1-2H3,(H,23,24);1-7,11H,8-9,21H2,(H,22,23);2-9H,10-11,20H2,1H3;4,6-11H,2-3,5,12,19H2,1H3
InChIKeyHEKPAERHCQDICZ-UHFFFAOYSA-N
XLogP18.89
TPSA575.54 Ų
H-Bond Donors9
H-Bond Acceptors36
Rotatable Bonds32
Heavy Atoms164
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002194.44
LogP ≤ 518.89
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1036

Analyze 1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one with MolForge

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Related Compounds

1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-methylphenyl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(4-methyl-1H-pyrazol-5-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one
CID 157539510
1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(4-methyl-1H-pyrazol-5-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one
CID 159324046
1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(4-methyl-1H-pyrazol-5-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one
CID 159641502
1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(4-fluoro-3-methylphenyl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(4-methyl-1H-pyrazol-5-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one
CID 159686633
6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine
CID 160874523
1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one
CID 161978100
1-[6-(3-amino-1H-indazol-4-yl)-5-fluoronaphthalen-1-yl]-2-phenylethanone;1-[6-(3-amino-1H-indazol-4-yl)naphthalen-1-yl]butan-1-one;1-[6-(3-amino-1H-indazol-4-yl)naphthalen-1-yl]-2-cyclopropylethanone;1-[6-(3-amino-1H-indazol-4-yl)naphthalen-1-yl]-2-(2-fluoro-4-methylphenyl)ethanone;1-[6-(3-amino-1H-indazol-4-yl)naphthalen-1-yl]-2-(3-fluoro-4-methylphenyl)ethanone;1-[6-(3-amino-1H-indazol-4-yl)naphthalen-1-yl]-2-(5-methyl-1,2-oxazol-3-yl)ethanone;1-[6-(3-amino-1H-indazol-4-yl)naphthalen-1-yl]-2-pyridin-3-ylethanone
CID 159204198
1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2-methoxyphenyl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-methylphenyl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(4-methyl-1H-pyrazol-5-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one
CID 161694748

Frequently Asked Questions

What is the IUPAC name of 1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one?
The IUPAC name of 1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one (CID 158454656) is 1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one.
What is the SMILES notation for 1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one?
The canonical SMILES for 1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one is CC(C)c1cc(CC(=O)Cc2ccc(-c3cccn4nnc(N)c34)cc2)[nH]n1.CCCCC(=O)Cc1ccc(-c2cccn3nnc(N)c23)cc1.Cc1cc(CC(=O)Cc2ccc(-c3cccn4nnc(N)c34)cc2)no1.Cc1ccc(CC(=O)Cc2ccc(-c3cccn4nnc(N)c34)cc2)cc1C(F)(F)F.N#Cc1cn[nH]c1CC(=O)Cc1ccc(-c2cccn3nnc(N)c23)cc1.Nc1nnn2cccc(-c3ccc(CC(=O)Cc4[nH]nc5ccccc45)cc3)c12.
What is the InChIKey of 1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one?
The InChIKey is HEKPAERHCQDICZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19F3N4O.C22H18N6O.C21H22N6O.C19H15N7O.C19H17N5O2.C18H20N4O/c1-14-4-5-16(13-20(14)23(24,25)26)12-18(31)11-15-6-8-17(9-7-15)19-3-2-10-30-21(19)22(27)28-29-30;23-22-21-17(5-3-11-28(21)27-26-22)15-9-7-14(8-10-15)12-16(29)13-20-18-4-1-2-6-19(18)24-25-20;1-13(2)19-12-16(23-24-19)11-17(28)10-14-5-7-15(8-6-14)18-4-3-9-27-20(18)21(22)25-26-27;20-10-14-11-22-23-17(14)9-15(27)8-12-3-5-13(6-4-12)16-2-1-7-26-18(16)19(21)24-25-26;1-12-9-15(22-26-12)11-16(25)10-13-4-6-14(7-5-13)17-3-2-8-24-18(17)19(20)21-23-24;1-2-3-5-15(23)12-13-7-9-14(10-8-13)16-6-4-11-22-17(16)18(19)20-21-22/h2-10,13H,11-12,27H2,1H3;1-11H,12-13,23H2,(H,24,25);3-9,12-13H,10-11,22H2,1-2H3,(H,23,24);1-7,11H,8-9,21H2,(H,22,23);2-9H,10-11,20H2,1H3;4,6-11H,2-3,5,12,19H2,1H3.
What are the key properties of 1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one?
1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one has a molecular weight of 2194.44 g/mol, XLogP of 18.89, 32 rotatable bonds, 9 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one is sourced from PubChem (CID 158454656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).