2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C89H73F5N38O9S2 — CID 158520982

IUPAC2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCS(=O)(=O)c1ccc(-c2ccncc2NC(=O)c2c(N)nn3cc(F)cnc23)cc1.Cc1nccnc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12.Cc1nn(C)cc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12.Cn1ncnc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12.Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(S(=O)(=O)N2CCC2)cc1
InChIInChI=1S/C21H18FN7O3S.C19H15FN6O3S.C17H15FN8O.C17H13FN8O.C15H12FN9O/c22-14-10-25-20-18(19(23)27-29(20)12-14)21(30)26-17-11-24-7-6-16(17)13-2-4-15(5-3-13)33(31,32)28-8-1-9-28;1-30(28,29)13-4-2-11(3-5-13)14-6-7-22-9-15(14)24-19(27)16-17(21)25-26-10-12(20)8-23-18(16)26;1-9-12(8-25(2)23-9)11-3-4-20-6-13(11)22-17(27)14-15(19)24-26-7-10(18)5-21-16(14)26;1-9-14(22-5-4-21-9)11-2-3-20-7-12(11)24-17(27)13-15(19)25-26-8-10(18)6-23-16(13)26;1-24-13(20-7-21-24)9-2-3-18-5-10(9)22-15(26)11-12(17)23-25-6-8(16)4-19-14(11)25/h2-7,10-12H,1,8-9H2,(H2,23,27)(H,26,30);2-10H,1H3,(H2,21,25)(H,24,27);3-8H,1-2H3,(H2,19,24)(H,22,27);2-8H,1H3,(H2,19,25)(H,24,27);2-7H,1H3,(H2,17,23)(H,22,26)
InChIKeyHMFAFKXAAAQEBW-UHFFFAOYSA-N
MW1977.94 g/mol
LogP8.89
Rot. Bonds18

About 2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 158520982) has the molecular formula C89H73F5N38O9S2 and a molecular weight of 1977.94 g/mol. Its IUPAC name is 2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID158520982
Molecular FormulaC89H73F5N38O9S2
Molecular Weight1977.94 g/mol
Exact Mass1976.58
IUPAC Name2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCS(=O)(=O)c1ccc(-c2ccncc2NC(=O)c2c(N)nn3cc(F)cnc23)cc1.Cc1nccnc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12.Cc1nn(C)cc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12.Cn1ncnc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12.Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(S(=O)(=O)N2CCC2)cc1
InChIInChI=1S/C21H18FN7O3S.C19H15FN6O3S.C17H15FN8O.C17H13FN8O.C15H12FN9O/c22-14-10-25-20-18(19(23)27-29(20)12-14)21(30)26-17-11-24-7-6-16(17)13-2-4-15(5-3-13)33(31,32)28-8-1-9-28;1-30(28,29)13-4-2-11(3-5-13)14-6-7-22-9-15(14)24-19(27)16-17(21)25-26-10-12(20)8-23-18(16)26;1-9-12(8-25(2)23-9)11-3-4-20-6-13(11)22-17(27)14-15(19)24-26-7-10(18)5-21-16(14)26;1-9-14(22-5-4-21-9)11-2-3-20-7-12(11)24-17(27)13-15(19)25-26-8-10(18)6-23-16(13)26;1-24-13(20-7-21-24)9-2-3-18-5-10(9)22-15(26)11-12(17)23-25-6-8(16)4-19-14(11)25/h2-7,10-12H,1,8-9H2,(H2,23,27)(H,26,30);2-10H,1H3,(H2,21,25)(H,24,27);3-8H,1-2H3,(H2,19,24)(H,22,27);2-8H,1H3,(H2,19,25)(H,24,27);2-7H,1H3,(H2,17,23)(H,22,26)
InChIKeyHMFAFKXAAAQEBW-UHFFFAOYSA-N
XLogP8.89
TPSA636.83 Ų
H-Bond Donors10
H-Bond Acceptors41
Rotatable Bonds18
Heavy Atoms143
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001977.94
LogP ≤ 58.89
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1041

Analyze 2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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Related Compounds

4-[(1R,5S)-3-[7-amino-3-[6-(2-fluorophenyl)-3-pyridinyl]-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-5-yl]-8-azabicyclo[3.2.1]octane-8-carbonyl]-N'-[3-(dimethylamino)propyl]-N-ethyltriazole-2-carboximidamide
CID 67294349
(3S,4R)-3-ethyl-4-[5-(4-methylphenyl)sulfonyl-1,5,7,10,11-pentazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3R,4S)-3-ethyl-4-[5-(4-methylphenyl)sulfonyl-1,5,7,10,11-pentazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;3-ethyl-4-[5-(4-methylphenyl)sulfonyl-1,5,7,10,11-pentazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide
CID 157110987
2-[6-[7-(Difluoromethylsulfanyl)imidazo[1,2-a]pyridin-2-yl]-5-ethylsulfonyl-3-pyridinyl]-2-methylpropanenitrile;2-[6-[5-ethyl-3-methyl-4-oxo-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]-5-ethylsulfonyl-3-pyridinyl]-2-methylpropanenitrile;2-[5-ethylsulfonyl-6-[7-(1,1,2,2,2-pentafluoroethyl)imidazo[1,2-a]pyridin-2-yl]-3-pyridinyl]-2-methylpropanenitrile;2-[5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-b]pyridazin-2-yl]-3-pyridinyl]-2-methylpropanenitrile;2-[5-ethylsulfonyl-6-[7-(trifluoromethyl)imidazo[1,2-c]pyrimidin-2-yl]-3-pyridinyl]-2-methylpropanenitrile;2-[5-ethylsulfonyl-6-[6-(trifluoromethyl)pyrazolo[4,3-c]pyridin-2-yl]-3-pyridinyl]-2-methylpropanenitrile;2-[5-ethylsulfonyl-6-[7-(trifluoromethylsulfanyl)imidazo[1,2-a]pyridin-2-yl]-3-pyridinyl]-2-methylpropanenitrile
CID 157504965
(4-ethylsulfonylpiperazin-1-yl)-[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazin-2-yl]methanone;2-[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carbonyl]-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-9-one;1-[4-[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carbonyl]piperazin-1-yl]propan-1-one;[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazin-2-yl]-[4-(2-imidazol-1-ylethyl)piperazin-1-yl]methanone
CID 158099691
(3,3-difluoroazetidin-1-yl)-[(3S,4R)-3-ethyl-4-[5-(4-methylphenyl)sulfonyl-1,5,7,10,11-pentazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl]pyrrolidin-1-yl]methanone;12-[(3R,4S)-4-ethylpyrrolidin-3-yl]-5-(4-methylphenyl)sulfonyl-1,5,7,10,11-pentazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaene
CID 158274236
N-cyclopropyl-2-[4-[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carbonyl]piperazin-1-yl]propanamide;(4-ethylsulfonylpiperazin-1-yl)-[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazin-2-yl]methanone;2-[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carbonyl]-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-9-one;[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazin-2-yl]-[4-(2-imidazol-1-ylethyl)piperazin-1-yl]methanone
CID 158323299
N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-4,4-difluoro-5-methylpiperidin-3-yl]methyl]methanesulfonamide;4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]morpholine-2-carboxamide;N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]methyl]methanesulfonamide;[3-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]piperidin-1-yl]-(1-methylpyrazol-4-yl)methanone;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)piperidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine
CID 158608804
1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)ethyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-d]pyrimidine-4-carboxamide
CID 159322771
5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-3-[7-[3-fluoro-5-(2-methylsulfonylethyl)phenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridine;3-methyl-N-[5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]butanamide;5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-amine;N-[5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]propanamide
CID 159591884
4-[1-[(7-Amino-5-methyl-[1,2,5]oxadiazolo[3,4-b]pyridin-6-yl)methyl]pyrazol-3-yl]-2-fluorobenzonitrile;6-[[4-(1,1-difluoroethyl)pyrazol-1-yl]methyl]-5-methyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;6-[[3-(1,1-dioxo-1,2-thiazolidin-2-yl)pyrazol-1-yl]methyl]-5-methyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;6-[[3-(2-fluoro-4-methylsulfonylphenyl)pyrazol-1-yl]methyl]-5-methyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;5-methyl-6-[[3-(2-methylpyrazol-3-yl)pyrazol-1-yl]methyl]-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine
CID 159637348
(4-ethylsulfonylpiperazin-1-yl)-[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazin-2-yl]methanone;4-[6-(4-fluorophenyl)-8-methylimidazo[1,2-b]pyridazine-2-carbonyl]piperazine-1-carbonitrile;2-[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carbonyl]-3,4,6,7,8,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-9-one;1-[4-[6-(4-fluorophenyl)-8-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carbonyl]piperazin-1-yl]propan-1-one
CID 160947496
2-amino-N-[5-[4-[(3,3-difluoropyrrolidin-1-yl)methyl]piperidin-1-yl]pyridazin-4-yl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)piperidin-1-yl]pyridazin-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[5-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]pyridazin-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[5-(2-methyl-3-pyridinyl)pyridazin-4-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 162133782

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 158520982) is 2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is CS(=O)(=O)c1ccc(-c2ccncc2NC(=O)c2c(N)nn3cc(F)cnc23)cc1.Cc1nccnc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12.Cc1nn(C)cc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12.Cn1ncnc1-c1ccncc1NC(=O)c1c(N)nn2cc(F)cnc12.Nc1nn2cc(F)cnc2c1C(=O)Nc1cnccc1-c1ccc(S(=O)(=O)N2CCC2)cc1.
What is the InChIKey of 2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is HMFAFKXAAAQEBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18FN7O3S.C19H15FN6O3S.C17H15FN8O.C17H13FN8O.C15H12FN9O/c22-14-10-25-20-18(19(23)27-29(20)12-14)21(30)26-17-11-24-7-6-16(17)13-2-4-15(5-3-13)33(31,32)28-8-1-9-28;1-30(28,29)13-4-2-11(3-5-13)14-6-7-22-9-15(14)24-19(27)16-17(21)25-26-10-12(20)8-23-18(16)26;1-9-12(8-25(2)23-9)11-3-4-20-6-13(11)22-17(27)14-15(19)24-26-7-10(18)5-21-16(14)26;1-9-14(22-5-4-21-9)11-2-3-20-7-12(11)24-17(27)13-15(19)25-26-8-10(18)6-23-16(13)26;1-24-13(20-7-21-24)9-2-3-18-5-10(9)22-15(26)11-12(17)23-25-6-8(16)4-19-14(11)25/h2-7,10-12H,1,8-9H2,(H2,23,27)(H,26,30);2-10H,1H3,(H2,21,25)(H,24,27);3-8H,1-2H3,(H2,19,24)(H,22,27);2-8H,1H3,(H2,19,25)(H,24,27);2-7H,1H3,(H2,17,23)(H,22,26).
What are the key properties of 2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 1977.94 g/mol, XLogP of 8.89, 18 rotatable bonds, 10 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-[4-(azetidin-1-ylsulfonyl)phenyl]-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-(1,3-dimethylpyrazol-4-yl)-3-pyridinyl]-6-fluoropyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(3-methylpyrazin-2-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(4-methylsulfonylphenyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-6-fluoro-N-[4-(2-methyl-1,2,4-triazol-3-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 158520982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).