N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C157H189F5N54O18 — CID 165000773

IUPACN-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNc1cc(Nc2cc(F)cn(C)c2=O)nc2c(C(=O)NC3C[C@@H]3C)cnn12.CNc1cc(Nc2cc(F)cn(C)c2=O)nc2c(C(=O)NCC(C)(C)C)cnn12.CNc1cc(Nc2cccn(C)c2=O)nc2c(C(=O)NC3(C)CC3)cnn12.CNc1cc(Nc2cccn(C)c2=O)nc2c(C(=O)NC3CC(C)(C)C3)cnn12.CNc1cc(Nc2cccn(C)c2=O)nc2c(C(=O)NC3CC(C)C3)cnn12.CNc1cc(Nc2cccn(C)c2=O)nc2c(C(=O)NC3CCCC3)cnn12.[2H]C([2H])([2H])Nc1cc(Nc2c(F)c(F)cc3c2OCCO3)nc2c(C(=O)NCC(C)(C)CC)cnn12.[2H]C([2H])([2H])Nc1cc(Nc2cc(F)cc3c2OCCO3)nc2c(C(=O)NCC(C)(C)CC)cnn12
InChIInChI=1S/C22H26F2N6O3.C22H27FN6O3.C20H25N7O2.C19H24FN7O2.2C19H23N7O2.C18H20FN7O2.C18H21N7O2/c1-5-22(2,3)11-26-21(31)12-10-27-30-16(25-4)9-15(29-20(12)30)28-18-17(24)13(23)8-14-19(18)33-7-6-32-14;1-5-22(2,3)12-25-21(30)14-11-26-29-18(24-4)10-17(28-20(14)29)27-15-8-13(23)9-16-19(15)32-7-6-31-16;1-20(2)9-12(10-20)23-18(28)13-11-22-27-16(21-3)8-15(25-17(13)27)24-14-6-5-7-26(4)19(14)29;1-19(2,3)10-22-17(28)12-8-23-27-15(21-4)7-14(25-16(12)27)24-13-6-11(20)9-26(5)18(13)29;1-11-7-12(8-11)22-18(27)13-10-21-26-16(20-2)9-15(24-17(13)26)23-14-5-4-6-25(3)19(14)28;1-20-16-10-15(23-14-8-5-9-25(2)19(14)28)24-17-13(11-21-26(16)17)18(27)22-12-6-3-4-7-12;1-9-4-12(9)23-17(27)11-7-21-26-15(20-2)6-14(24-16(11)26)22-13-5-10(19)8-25(3)18(13)28;1-18(6-7-18)23-16(26)11-10-20-25-14(19-2)9-13(22-15(11)25)21-12-5-4-8-24(3)17(12)27/h8-10,25H,5-7,11H2,1-4H3,(H,26,31)(H,28,29);8-11,24H,5-7,12H2,1-4H3,(H,25,30)(H,27,28);5-8,11-12,21H,9-10H2,1-4H3,(H,23,28)(H,24,25);6-9,21H,10H2,1-5H3,(H,22,28)(H,24,25);4-6,9-12,20H,7-8H2,1-3H3,(H,22,27)(H,23,24);5,8-12,20H,3-4,6-7H2,1-2H3,(H,22,27)(H,23,24);5-9,12,20H,4H2,1-3H3,(H,22,24)(H,23,27);4-5,8-10,19H,6-7H2,1-3H3,(H,21,22)(H,23,26)/t;;;;;;9-,12?;/m......0./s1/i2*4D3;;;;;;
InChIKeyIFJNWCRLKMIICC-DZQNGNOQSA-N
MW3221.63 g/mol
LogP18.19
Rot. Bonds46

About N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 165000773) has the molecular formula C157H189F5N54O18 and a molecular weight of 3221.63 g/mol. Its IUPAC name is N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID165000773
Molecular FormulaC157H189F5N54O18
Molecular Weight3221.63 g/mol
Exact Mass3219.58
IUPAC NameN-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNc1cc(Nc2cc(F)cn(C)c2=O)nc2c(C(=O)NC3C[C@@H]3C)cnn12.CNc1cc(Nc2cc(F)cn(C)c2=O)nc2c(C(=O)NCC(C)(C)C)cnn12.CNc1cc(Nc2cccn(C)c2=O)nc2c(C(=O)NC3(C)CC3)cnn12.CNc1cc(Nc2cccn(C)c2=O)nc2c(C(=O)NC3CC(C)(C)C3)cnn12.CNc1cc(Nc2cccn(C)c2=O)nc2c(C(=O)NC3CC(C)C3)cnn12.CNc1cc(Nc2cccn(C)c2=O)nc2c(C(=O)NC3CCCC3)cnn12.[2H]C([2H])([2H])Nc1cc(Nc2c(F)c(F)cc3c2OCCO3)nc2c(C(=O)NCC(C)(C)CC)cnn12.[2H]C([2H])([2H])Nc1cc(Nc2cc(F)cc3c2OCCO3)nc2c(C(=O)NCC(C)(C)CC)cnn12
InChIInChI=1S/C22H26F2N6O3.C22H27FN6O3.C20H25N7O2.C19H24FN7O2.2C19H23N7O2.C18H20FN7O2.C18H21N7O2/c1-5-22(2,3)11-26-21(31)12-10-27-30-16(25-4)9-15(29-20(12)30)28-18-17(24)13(23)8-14-19(18)33-7-6-32-14;1-5-22(2,3)12-25-21(30)14-11-26-29-18(24-4)10-17(28-20(14)29)27-15-8-13(23)9-16-19(15)32-7-6-31-16;1-20(2)9-12(10-20)23-18(28)13-11-22-27-16(21-3)8-15(25-17(13)27)24-14-6-5-7-26(4)19(14)29;1-19(2,3)10-22-17(28)12-8-23-27-15(21-4)7-14(25-16(12)27)24-13-6-11(20)9-26(5)18(13)29;1-11-7-12(8-11)22-18(27)13-10-21-26-16(20-2)9-15(24-17(13)26)23-14-5-4-6-25(3)19(14)28;1-20-16-10-15(23-14-8-5-9-25(2)19(14)28)24-17-13(11-21-26(16)17)18(27)22-12-6-3-4-7-12;1-9-4-12(9)23-17(27)11-7-21-26-15(20-2)6-14(24-16(11)26)22-13-5-10(19)8-25(3)18(13)28;1-18(6-7-18)23-16(26)11-10-20-25-14(19-2)9-13(22-15(11)25)21-12-5-4-8-24(3)17(12)27/h8-10,25H,5-7,11H2,1-4H3,(H,26,31)(H,28,29);8-11,24H,5-7,12H2,1-4H3,(H,25,30)(H,27,28);5-8,11-12,21H,9-10H2,1-4H3,(H,23,28)(H,24,25);6-9,21H,10H2,1-5H3,(H,22,28)(H,24,25);4-6,9-12,20H,7-8H2,1-3H3,(H,22,27)(H,23,24);5,8-12,20H,3-4,6-7H2,1-2H3,(H,22,27)(H,23,24);5-9,12,20H,4H2,1-3H3,(H,22,24)(H,23,27);4-5,8-10,19H,6-7H2,1-3H3,(H,21,22)(H,23,26)/t;;;;;;9-,12?;/m......0./s1/i2*4D3;;;;;;
InChIKeyIFJNWCRLKMIICC-DZQNGNOQSA-N
XLogP18.19
TPSA835.72 Ų
H-Bond Donors24
H-Bond Acceptors64
Rotatable Bonds46
Heavy Atoms234
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003221.63
LogP ≤ 518.19
H-Bond Donors ≤ 524
H-Bond Acceptors ≤ 1064

Analyze N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 165000773) is N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide is CNc1cc(Nc2cc(F)cn(C)c2=O)nc2c(C(=O)NC3C[C@@H]3C)cnn12.CNc1cc(Nc2cc(F)cn(C)c2=O)nc2c(C(=O)NCC(C)(C)C)cnn12.CNc1cc(Nc2cccn(C)c2=O)nc2c(C(=O)NC3(C)CC3)cnn12.CNc1cc(Nc2cccn(C)c2=O)nc2c(C(=O)NC3CC(C)(C)C3)cnn12.CNc1cc(Nc2cccn(C)c2=O)nc2c(C(=O)NC3CC(C)C3)cnn12.CNc1cc(Nc2cccn(C)c2=O)nc2c(C(=O)NC3CCCC3)cnn12.[2H]C([2H])([2H])Nc1cc(Nc2c(F)c(F)cc3c2OCCO3)nc2c(C(=O)NCC(C)(C)CC)cnn12.[2H]C([2H])([2H])Nc1cc(Nc2cc(F)cc3c2OCCO3)nc2c(C(=O)NCC(C)(C)CC)cnn12.
What is the InChIKey of N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is IFJNWCRLKMIICC-DZQNGNOQSA-N. The full InChI is InChI=1S/C22H26F2N6O3.C22H27FN6O3.C20H25N7O2.C19H24FN7O2.2C19H23N7O2.C18H20FN7O2.C18H21N7O2/c1-5-22(2,3)11-26-21(31)12-10-27-30-16(25-4)9-15(29-20(12)30)28-18-17(24)13(23)8-14-19(18)33-7-6-32-14;1-5-22(2,3)12-25-21(30)14-11-26-29-18(24-4)10-17(28-20(14)29)27-15-8-13(23)9-16-19(15)32-7-6-31-16;1-20(2)9-12(10-20)23-18(28)13-11-22-27-16(21-3)8-15(25-17(13)27)24-14-6-5-7-26(4)19(14)29;1-19(2,3)10-22-17(28)12-8-23-27-15(21-4)7-14(25-16(12)27)24-13-6-11(20)9-26(5)18(13)29;1-11-7-12(8-11)22-18(27)13-10-21-26-16(20-2)9-15(24-17(13)26)23-14-5-4-6-25(3)19(14)28;1-20-16-10-15(23-14-8-5-9-25(2)19(14)28)24-17-13(11-21-26(16)17)18(27)22-12-6-3-4-7-12;1-9-4-12(9)23-17(27)11-7-21-26-15(20-2)6-14(24-16(11)26)22-13-5-10(19)8-25(3)18(13)28;1-18(6-7-18)23-16(26)11-10-20-25-14(19-2)9-13(22-15(11)25)21-12-5-4-8-24(3)17(12)27/h8-10,25H,5-7,11H2,1-4H3,(H,26,31)(H,28,29);8-11,24H,5-7,12H2,1-4H3,(H,25,30)(H,27,28);5-8,11-12,21H,9-10H2,1-4H3,(H,23,28)(H,24,25);6-9,21H,10H2,1-5H3,(H,22,28)(H,24,25);4-6,9-12,20H,7-8H2,1-3H3,(H,22,27)(H,23,24);5,8-12,20H,3-4,6-7H2,1-2H3,(H,22,27)(H,23,24);5-9,12,20H,4H2,1-3H3,(H,22,24)(H,23,27);4-5,8-10,19H,6-7H2,1-3H3,(H,21,22)(H,23,26)/t;;;;;;9-,12?;/m......0./s1/i2*4D3;;;;;;.
What are the key properties of N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 3221.63 g/mol, XLogP of 18.19, 46 rotatable bonds, 24 hydrogen bond donors, and 64 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(6,7-difluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-N-(2,2-dimethylbutyl)-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylbutyl)-5-[(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)amino]-7-(trideuteriomethylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3,3-dimethylcyclobutyl)-7-(methylamino)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(2,2-dimethylpropyl)-5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;5-[(5-fluoro-1-methyl-2-oxo-3-pyridinyl)amino]-7-(methylamino)-N-[(2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(3-methylcyclobutyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(methylamino)-N-(1-methylcyclopropyl)-5-[(1-methyl-2-oxo-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 165000773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).