About 3-amino-1H-pyridin-2-one;bis(tert-butyl 4-(3-amino-2-oxo-1-pyridinyl)-3,6-dihydro-2H-pyridine-1-carboxylate);tert-butyl 4-bromo-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl N-[5-chloro-3-(cyclopropylcarbamoyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]piperidine-1-carboxylate;N-cyclopropyl-7-(methylamino)-5-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;prop-2-enenitrile
3-amino-1H-pyridin-2-one;bis(tert-butyl 4-(3-amino-2-oxo-1-pyridinyl)-3,6-dihydro-2H-pyridine-1-carboxylate);tert-butyl 4-bromo-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl N-[5-chloro-3-(cyclopropylcarbamoyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]piperidine-1-carboxylate;N-cyclopropyl-7-(methylamino)-5-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;prop-2-enenitrile (PubChem CID 161048407) has the molecular formula C147H195BrClN39O26
and a molecular weight of 3039.78 g/mol. Its IUPAC name is 3-amino-1H-pyridin-2-one;bis(tert-butyl 4-(3-amino-2-oxo-1-pyridinyl)-3,6-dihydro-2H-pyridine-1-carboxylate);tert-butyl 4-bromo-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl N-[5-chloro-3-(cyclopropylcarbamoyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]piperidine-1-carboxylate;N-cyclopropyl-7-(methylamino)-5-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;prop-2-enenitrile.
Frequently Asked Questions
What is the IUPAC name of 3-amino-1H-pyridin-2-one;bis(tert-butyl 4-(3-amino-2-oxo-1-pyridinyl)-3,6-dihydro-2H-pyridine-1-carboxylate);tert-butyl 4-bromo-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl N-[5-chloro-3-(cyclopropylcarbamoyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]piperidine-1-carboxylate;N-cyclopropyl-7-(methylamino)-5-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;prop-2-enenitrile?
The IUPAC name of 3-amino-1H-pyridin-2-one;bis(tert-butyl 4-(3-amino-2-oxo-1-pyridinyl)-3,6-dihydro-2H-pyridine-1-carboxylate);tert-butyl 4-bromo-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl N-[5-chloro-3-(cyclopropylcarbamoyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]piperidine-1-carboxylate;N-cyclopropyl-7-(methylamino)-5-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;prop-2-enenitrile (CID 161048407) is 3-amino-1H-pyridin-2-one;bis(tert-butyl 4-(3-amino-2-oxo-1-pyridinyl)-3,6-dihydro-2H-pyridine-1-carboxylate);tert-butyl 4-bromo-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl N-[5-chloro-3-(cyclopropylcarbamoyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]piperidine-1-carboxylate;N-cyclopropyl-7-(methylamino)-5-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;prop-2-enenitrile.
What is the SMILES notation for 3-amino-1H-pyridin-2-one;bis(tert-butyl 4-(3-amino-2-oxo-1-pyridinyl)-3,6-dihydro-2H-pyridine-1-carboxylate);tert-butyl 4-bromo-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl N-[5-chloro-3-(cyclopropylcarbamoyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]piperidine-1-carboxylate;N-cyclopropyl-7-(methylamino)-5-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;prop-2-enenitrile?
The canonical SMILES for 3-amino-1H-pyridin-2-one;bis(tert-butyl 4-(3-amino-2-oxo-1-pyridinyl)-3,6-dihydro-2H-pyridine-1-carboxylate);tert-butyl 4-bromo-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl N-[5-chloro-3-(cyclopropylcarbamoyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]piperidine-1-carboxylate;N-cyclopropyl-7-(methylamino)-5-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;prop-2-enenitrile is C=CC#N.CC(C)(C)OC(=O)N1CC=C(Br)CC1.CC(C)(C)OC(=O)N1CC=C(n2cccc(N)c2=O)CC1.CC(C)(C)OC(=O)N1CC=C(n2cccc(N)c2=O)CC1.CN(C(=O)OC(C)(C)C)c1cc(Cl)nc2c(C(=O)NC3CC3)cnn12.CN(C(=O)OC(C)(C)C)c1cc(Nc2cccn(C3=CCN(C(=O)OC(C)(C)C)CC3)c2=O)nc2c(C(=O)NC3CC3)cnn12.CN(C(=O)OC(C)(C)C)c1cc(Nc2cccn(C3CCN(C(=O)OC(C)(C)C)CC3)c2=O)nc2c(C(=O)NC3CC3)cnn12.CNc1cc(Nc2cccn(C3CCNCC3)c2=O)nc2c(C(=O)NC3CC3)cnn12.Nc1ccc[nH]c1=O.
What is the InChIKey of 3-amino-1H-pyridin-2-one;bis(tert-butyl 4-(3-amino-2-oxo-1-pyridinyl)-3,6-dihydro-2H-pyridine-1-carboxylate);tert-butyl 4-bromo-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl N-[5-chloro-3-(cyclopropylcarbamoyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]piperidine-1-carboxylate;N-cyclopropyl-7-(methylamino)-5-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;prop-2-enenitrile?
The InChIKey is UBUPUTZTVWVANA-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H42N8O6.C31H40N8O6.C21H26N8O2.C16H20ClN5O3.2C15H21N3O3.C10H16BrNO2.C5H6N2O.C3H3N/c2*1-30(2,3)44-28(42)36(7)24-17-23(35-25-21(18-32-39(24)25)26(40)33-19-10-11-19)34-22-9-8-14-38(27(22)41)20-12-15-37(16-13-20)29(43)45-31(4,5)6;1-22-18-11-17(27-19-15(12-24-29(18)19)20(30)25-13-4-5-13)26-16-3-2-10-28(21(16)31)14-6-8-23-9-7-14;1-16(2,3)25-15(24)21(4)12-7-11(17)20-13-10(8-18-22(12)13)14(23)19-9-5-6-9;2*1-15(2,3)21-14(20)17-9-6-11(7-10-17)18-8-4-5-12(16)13(18)19;1-10(2,3)14-9(13)12-6-4-8(11)5-7-12;6-4-2-1-3-7-5(4)8;1-2-3-4/h8-9,14,17-20H,10-13,15-16H2,1-7H3,(H,33,40)(H,34,35);8-9,12,14,17-19H,10-11,13,15-16H2,1-7H3,(H,33,40)(H,34,35);2-3,10-14,22-23H,4-9H2,1H3,(H,25,30)(H,26,27);7-9H,5-6H2,1-4H3,(H,19,23);2*4-6,8H,7,9-10,16H2,1-3H3;4H,5-7H2,1-3H3;1-3H,6H2,(H,7,8);2H,1H2.
What are the key properties of 3-amino-1H-pyridin-2-one;bis(tert-butyl 4-(3-amino-2-oxo-1-pyridinyl)-3,6-dihydro-2H-pyridine-1-carboxylate);tert-butyl 4-bromo-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl N-[5-chloro-3-(cyclopropylcarbamoyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]piperidine-1-carboxylate;N-cyclopropyl-7-(methylamino)-5-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;prop-2-enenitrile?
3-amino-1H-pyridin-2-one;bis(tert-butyl 4-(3-amino-2-oxo-1-pyridinyl)-3,6-dihydro-2H-pyridine-1-carboxylate);tert-butyl 4-bromo-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl N-[5-chloro-3-(cyclopropylcarbamoyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]piperidine-1-carboxylate;N-cyclopropyl-7-(methylamino)-5-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;prop-2-enenitrile has a molecular weight of 3039.78 g/mol, XLogP of 20.37, 23 rotatable bonds, 13 hydrogen bond donors, and 52 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1H-pyridin-2-one;bis(tert-butyl 4-(3-amino-2-oxo-1-pyridinyl)-3,6-dihydro-2H-pyridine-1-carboxylate);tert-butyl 4-bromo-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl N-[5-chloro-3-(cyclopropylcarbamoyl)pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[3-[[3-(cyclopropylcarbamoyl)-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidin-5-yl]amino]-2-oxo-1-pyridinyl]piperidine-1-carboxylate;N-cyclopropyl-7-(methylamino)-5-[(2-oxo-1-piperidin-4-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;prop-2-enenitrile is sourced from PubChem (CID 161048407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).