About 3-amino-1-propan-2-ylpyridin-2-one;tert-butyl N-[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;bis(ethyl 7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate);3-[[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-propan-2-ylpyridin-2-one;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;trans-(1R,2S)-2-amino-1-methylcyclobutan-1-ol
3-amino-1-propan-2-ylpyridin-2-one;tert-butyl N-[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;bis(ethyl 7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate);3-[[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-propan-2-ylpyridin-2-one;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;trans-(1R,2S)-2-amino-1-methylcyclobutan-1-ol (PubChem CID 157215028) has the molecular formula C144H192ClN37O29
and a molecular weight of 2940.80 g/mol. Its IUPAC name is 3-amino-1-propan-2-ylpyridin-2-one;tert-butyl N-[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;bis(ethyl 7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate);3-[[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-propan-2-ylpyridin-2-one;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;trans-(1R,2S)-2-amino-1-methylcyclobutan-1-ol.
Frequently Asked Questions
What is the IUPAC name of 3-amino-1-propan-2-ylpyridin-2-one;tert-butyl N-[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;bis(ethyl 7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate);3-[[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-propan-2-ylpyridin-2-one;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;trans-(1R,2S)-2-amino-1-methylcyclobutan-1-ol?
The IUPAC name of 3-amino-1-propan-2-ylpyridin-2-one;tert-butyl N-[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;bis(ethyl 7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate);3-[[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-propan-2-ylpyridin-2-one;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;trans-(1R,2S)-2-amino-1-methylcyclobutan-1-ol (CID 157215028) is 3-amino-1-propan-2-ylpyridin-2-one;tert-butyl N-[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;bis(ethyl 7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate);3-[[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-propan-2-ylpyridin-2-one;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;trans-(1R,2S)-2-amino-1-methylcyclobutan-1-ol.
What is the SMILES notation for 3-amino-1-propan-2-ylpyridin-2-one;tert-butyl N-[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;bis(ethyl 7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate);3-[[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-propan-2-ylpyridin-2-one;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;trans-(1R,2S)-2-amino-1-methylcyclobutan-1-ol?
The canonical SMILES for 3-amino-1-propan-2-ylpyridin-2-one;tert-butyl N-[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;bis(ethyl 7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate);3-[[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-propan-2-ylpyridin-2-one;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;trans-(1R,2S)-2-amino-1-methylcyclobutan-1-ol is CC(C)n1cccc(N)c1=O.CC(C)n1cccc(Nc2cc(N(C)C(=O)OC(C)(C)C)n3ncc(C(=O)C[C@H]4CC[C@@]4(C)O)c3n2)c1=O.CC(C)n1cccc(Nc2cc(N(C)C(=O)OC(C)(C)C)n3ncc(C(=O)O)c3n2)c1=O.CCOC(=O)c1cnn2c(N(C)C(=O)OC(C)(C)C)cc(Cl)nc12.CCOC(=O)c1cnn2c(N(C)C(=O)OC(C)(C)C)cc(Nc3cccn(C(C)C)c3=O)nc12.CCOC(=O)c1cnn2c(N(C)C(=O)OC(C)(C)C)cc(Nc3cccn(C(C)C)c3=O)nc12.CNc1cc(Nc2cccn(C(C)C)c2=O)nc2c(C(=O)C[C@H]3CC[C@@]3(C)O)cnn12.C[C@@]1(O)CC[C@@H]1N.
What is the InChIKey of 3-amino-1-propan-2-ylpyridin-2-one;tert-butyl N-[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;bis(ethyl 7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate);3-[[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-propan-2-ylpyridin-2-one;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;trans-(1R,2S)-2-amino-1-methylcyclobutan-1-ol?
The InChIKey is ASHVXTOPGNKYRD-JCFPGOQMSA-N. The full InChI is InChI=1S/C27H36N6O5.2C23H30N6O5.C22H28N6O3.C21H26N6O5.C15H19ClN4O4.C8H12N2O.C5H11NO/c1-16(2)32-12-8-9-19(24(32)35)29-21-14-22(31(7)25(36)38-26(3,4)5)33-23(30-21)18(15-28-33)20(34)13-17-10-11-27(17,6)37;2*1-8-33-21(31)15-13-24-29-18(27(7)22(32)34-23(4,5)6)12-17(26-19(15)29)25-16-10-9-11-28(14(2)3)20(16)30;1-13(2)27-9-5-6-16(21(27)30)25-18-11-19(23-4)28-20(26-18)15(12-24-28)17(29)10-14-7-8-22(14,3)31;1-12(2)26-9-7-8-14(18(26)28)23-15-10-16(25(6)20(31)32-21(3,4)5)27-17(24-15)13(11-22-27)19(29)30;1-6-23-13(21)9-8-17-20-11(7-10(16)18-12(9)20)19(5)14(22)24-15(2,3)4;1-6(2)10-5-3-4-7(9)8(10)11;1-5(7)3-2-4(5)6/h8-9,12,14-17,37H,10-11,13H2,1-7H3,(H,29,30);2*9-14H,8H2,1-7H3,(H,25,26);5-6,9,11-14,23,31H,7-8,10H2,1-4H3,(H,25,26);7-12H,1-6H3,(H,23,24)(H,29,30);7-8H,6H2,1-5H3;3-6H,9H2,1-2H3;4,7H,2-3,6H2,1H3/t17-,27-;;;14-,22-;;;;4-,5+/m1..1...0/s1.
What are the key properties of 3-amino-1-propan-2-ylpyridin-2-one;tert-butyl N-[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;bis(ethyl 7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate);3-[[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-propan-2-ylpyridin-2-one;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;trans-(1R,2S)-2-amino-1-methylcyclobutan-1-ol?
3-amino-1-propan-2-ylpyridin-2-one;tert-butyl N-[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;bis(ethyl 7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate);3-[[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-propan-2-ylpyridin-2-one;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;trans-(1R,2S)-2-amino-1-methylcyclobutan-1-ol has a molecular weight of 2940.80 g/mol, XLogP of 21.92, 35 rotatable bonds, 12 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-propan-2-ylpyridin-2-one;tert-butyl N-[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;bis(ethyl 7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate);3-[[3-[2-[(1R,2R)-2-hydroxy-2-methylcyclobutyl]acetyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-propan-2-ylpyridin-2-one;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;trans-(1R,2S)-2-amino-1-methylcyclobutan-1-ol is sourced from PubChem (CID 157215028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).