About 2-(1-amino-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-5-yl)benzamide;N-[3-[3-amino-5-[2-(3-fluoropyrrolidin-1-yl)ethyl]-4-methyl-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[3-amino-4-methyl-5-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-(3-amino-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-8-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide;5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;8-(2-chlorophenyl)-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine;11-methyl-8-(2-methylphenyl)-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine
2-(1-amino-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-5-yl)benzamide;N-[3-[3-amino-5-[2-(3-fluoropyrrolidin-1-yl)ethyl]-4-methyl-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[3-amino-4-methyl-5-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-(3-amino-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-8-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide;5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;8-(2-chlorophenyl)-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine;11-methyl-8-(2-methylphenyl)-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine (PubChem CID 158937986) has the molecular formula C152H153ClF10N34O7
and a molecular weight of 2793.56 g/mol. Its IUPAC name is 2-(1-amino-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-5-yl)benzamide;N-[3-[3-amino-5-[2-(3-fluoropyrrolidin-1-yl)ethyl]-4-methyl-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[3-amino-4-methyl-5-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-(3-amino-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-8-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide;5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;8-(2-chlorophenyl)-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine;11-methyl-8-(2-methylphenyl)-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine.
Frequently Asked Questions
What is the IUPAC name of 2-(1-amino-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-5-yl)benzamide;N-[3-[3-amino-5-[2-(3-fluoropyrrolidin-1-yl)ethyl]-4-methyl-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[3-amino-4-methyl-5-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-(3-amino-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-8-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide;5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;8-(2-chlorophenyl)-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine;11-methyl-8-(2-methylphenyl)-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine?
The IUPAC name of 2-(1-amino-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-5-yl)benzamide;N-[3-[3-amino-5-[2-(3-fluoropyrrolidin-1-yl)ethyl]-4-methyl-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[3-amino-4-methyl-5-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-(3-amino-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-8-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide;5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;8-(2-chlorophenyl)-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine;11-methyl-8-(2-methylphenyl)-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine (CID 158937986) is 2-(1-amino-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-5-yl)benzamide;N-[3-[3-amino-5-[2-(3-fluoropyrrolidin-1-yl)ethyl]-4-methyl-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[3-amino-4-methyl-5-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-(3-amino-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-8-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide;5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;8-(2-chlorophenyl)-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine;11-methyl-8-(2-methylphenyl)-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine.
What is the SMILES notation for 2-(1-amino-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-5-yl)benzamide;N-[3-[3-amino-5-[2-(3-fluoropyrrolidin-1-yl)ethyl]-4-methyl-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[3-amino-4-methyl-5-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-(3-amino-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-8-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide;5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;8-(2-chlorophenyl)-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine;11-methyl-8-(2-methylphenyl)-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine?
The canonical SMILES for 2-(1-amino-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-5-yl)benzamide;N-[3-[3-amino-5-[2-(3-fluoropyrrolidin-1-yl)ethyl]-4-methyl-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[3-amino-4-methyl-5-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-(3-amino-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-8-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide;5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;8-(2-chlorophenyl)-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine;11-methyl-8-(2-methylphenyl)-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine is CC1(C)CCc2c(-c3ccc4c(c3)OCO4)nc3n[nH]c(N)c3c2C1.CC1(C)CCc2c(-c3ccccc3C(N)=O)nc3n[nH]c(N)c3c2C1.CC1Cc2c(-c3ccccc3Cl)nc3n[nH]c(N)c3c2C1.Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1nc2n[nH]c(N)c2c(C)c1CCN1CCC(F)C1.Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1nc2n[nH]c(N)c2c(C)c1CCN1CCOCC1.Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-c1nc2n[nH]c(N)c2c2c1CC(C)C2.Cc1ccccc1-c1nc2n[nH]c(N)c2c2c1CC(C)C2.
What is the InChIKey of 2-(1-amino-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-5-yl)benzamide;N-[3-[3-amino-5-[2-(3-fluoropyrrolidin-1-yl)ethyl]-4-methyl-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[3-amino-4-methyl-5-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-(3-amino-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-8-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide;5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;8-(2-chlorophenyl)-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine;11-methyl-8-(2-methylphenyl)-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine?
The InChIKey is JJWSLTNILFRCTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28F4N6O.C28H29F3N6O2.C25H22F3N5O.C19H21N5O.C19H20N4O2.C17H18N4.C16H15ClN4/c1-15-6-7-20(34-27(39)17-4-3-5-18(12-17)28(30,31)32)13-22(15)24-21(9-11-38-10-8-19(29)14-38)16(2)23-25(33)36-37-26(23)35-24;1-16-6-7-20(33-27(38)18-4-3-5-19(14-18)28(29,30)31)15-22(16)24-21(8-9-37-10-12-39-13-11-37)17(2)23-25(32)35-36-26(23)34-24;1-12-8-18-19(9-12)21(31-23-20(18)22(29)32-33-23)17-11-16(7-6-13(17)2)30-24(34)14-4-3-5-15(10-14)25(26,27)28;1-19(2)8-7-11-13(9-19)14-16(20)23-24-18(14)22-15(11)10-5-3-4-6-12(10)17(21)25;1-19(2)6-5-11-12(8-19)15-17(20)22-23-18(15)21-16(11)10-3-4-13-14(7-10)25-9-24-13;1-9-7-12-13(8-9)15(11-6-4-3-5-10(11)2)19-17-14(12)16(18)20-21-17;1-8-6-10-11(7-8)14(9-4-2-3-5-12(9)17)19-16-13(10)15(18)20-21-16/h3-7,12-13,19H,8-11,14H2,1-2H3,(H,34,39)(H3,33,35,36,37);3-7,14-15H,8-13H2,1-2H3,(H,33,38)(H3,32,34,35,36);3-7,10-12H,8-9H2,1-2H3,(H,30,34)(H3,29,31,32,33);3-6H,7-9H2,1-2H3,(H2,21,25)(H3,20,22,23,24);3-4,7H,5-6,8-9H2,1-2H3,(H3,20,21,22,23);3-6,9H,7-8H2,1-2H3,(H3,18,19,20,21);2-5,8H,6-7H2,1H3,(H3,18,19,20,21).
What are the key properties of 2-(1-amino-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-5-yl)benzamide;N-[3-[3-amino-5-[2-(3-fluoropyrrolidin-1-yl)ethyl]-4-methyl-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[3-amino-4-methyl-5-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-(3-amino-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-8-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide;5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;8-(2-chlorophenyl)-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine;11-methyl-8-(2-methylphenyl)-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine?
2-(1-amino-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-5-yl)benzamide;N-[3-[3-amino-5-[2-(3-fluoropyrrolidin-1-yl)ethyl]-4-methyl-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[3-amino-4-methyl-5-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-(3-amino-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-8-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide;5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;8-(2-chlorophenyl)-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine;11-methyl-8-(2-methylphenyl)-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine has a molecular weight of 2793.56 g/mol, XLogP of 29.29, 20 rotatable bonds, 18 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-amino-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-5-yl)benzamide;N-[3-[3-amino-5-[2-(3-fluoropyrrolidin-1-yl)ethyl]-4-methyl-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-[3-amino-4-methyl-5-(2-morpholin-4-ylethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide;N-[3-(3-amino-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-8-yl)-4-methylphenyl]-3-(trifluoromethyl)benzamide;5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2,6,7,9-tetrahydropyrazolo[3,4-c]isoquinolin-1-amine;8-(2-chlorophenyl)-11-methyl-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine;11-methyl-8-(2-methylphenyl)-4,5,7-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7-tetraen-3-amine is sourced from PubChem (CID 158937986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).