N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine

C222H226F10N72O13S — CID 157082192

About N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine

N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine (PubChem CID 157082192) has the molecular formula C222H226F10N72O13S and a molecular weight of 4332.79 g/mol. Its IUPAC name is N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine.

Molecular Properties

• Compound Name: N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine
• PubChem CID: 157082192
• Molecular Formula: C222H226F10N72O13S
• Molecular Weight: 4332.79 g/mol
• Exact Mass: 4329.88
• IUPAC Name: N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine
• SMILES: COc1cc(-c2nc(Nc3ccc4[nH]ncc4c3C3CC3)n(C)n2)ccc1C(=O)NC1CC1.COc1cc(-c2nc(Nc3ccc4[nH]ncc4c3C3CC3)n(C)n2)ccc1C(=O)NC1CCN(CC(F)(F)F)C1.COc1cc(-c2nc(Nc3ccc4[nH]ncc4c3C3CC3)n(C)n2)cnc1C(=O)NC1CC1.Cn1nc(-c2ccc(C(=O)NC3CC3)c(F)c2)nc1Nc1ccc2[nH]ncc2c1C1CC1.Cn1nc(-c2ccc(C(=O)NCC(F)(F)F)nc2)nc1Nc1ccc2[nH]ncc2c1C1CC1.Cn1nc(-c2ccc(C(N)C(F)(F)F)cc2)nc1Nc1ccc2[nH]ncc2c1C1CC1.Cn1nc(-c2ccc(CNS(C)(=O)=O)cc2)nc1Nc1ccc2[nH]ncc2c1C1CC1.Cn1nc(-c2ccc3c(c2)CCNC3=O)nc1Nc1ccc2[nH]ncc2c1C1CC1.Cn1nc(-c2ccc3c(c2)COC3=O)nc1Nc1ccc2[nH]ncc2c1C1CC1.[H]/N=C/c1c(N)ccc(Nc2nc(C3=CCN(C)CC3)nn2C)c1C1CC1
• InChI: InChI=1S/C27H29F3N8O2.C24H25N7O2.C23H22FN7O.C23H24N8O2.C22H21N7O.C21H19F3N8O.C21H20F3N7.C21H23N7O2S.C21H18N6O2.C19H25N7/c1-37-26(33-21-8-7-20-19(12-31-35-20)23(21)15-3-4-15)34-24(36-37)16-5-6-18(22(11-16)40-2)25(39)32-17-9-10-38(13-17)14-27(28,29)30;1-31-24(27-19-10-9-18-17(12-25-29-18)21(19)13-3-4-13)28-22(30-31)14-5-8-16(20(11-14)33-2)23(32)26-15-6-7-15;1-31-23(27-19-9-8-18-16(11-25-29-18)20(19)12-2-3-12)28-21(30-31)13-4-7-15(17(24)10-13)22(32)26-14-5-6-14;1-31-23(27-17-8-7-16-15(11-25-29-16)19(17)12-3-4-12)28-21(30-31)13-9-18(33-2)20(24-10-13)22(32)26-14-5-6-14;1-29-22(25-18-7-6-17-16(11-24-27-17)19(18)12-2-3-12)26-20(28-29)14-4-5-15-13(10-14)8-9-23-21(15)30;1-32-20(28-15-7-6-14-13(9-27-30-14)17(15)11-2-3-11)29-18(31-32)12-4-5-16(25-8-12)19(33)26-10-21(22,23)24;1-31-20(27-16-9-8-15-14(10-26-29-15)17(16)11-2-3-11)28-19(30-31)13-6-4-12(5-7-13)18(25)21(22,23)24;1-28-21(24-18-10-9-17-16(12-22-26-17)19(18)14-7-8-14)25-20(27-28)15-5-3-13(4-6-15)11-23-31(2,29)30;1-27-21(23-17-7-6-16-15(9-22-25-16)18(17)11-2-3-11)24-19(26-27)12-4-5-14-13(8-12)10-29-20(14)28;1-25-9-7-13(8-10-25)18-23-19(26(2)24-18)22-16-6-5-15(21)14(11-20)17(16)12-3-4-12/h5-8,11-12,15,17H,3-4,9-10,13-14H2,1-2H3,(H,31,35)(H,32,39)(H,33,34,36);5,8-13,15H,3-4,6-7H2,1-2H3,(H,25,29)(H,26,32)(H,27,28,30);4,7-12,14H,2-3,5-6H2,1H3,(H,25,29)(H,26,32)(H,27,28,30);7-12,14H,3-6H2,1-2H3,(H,25,29)(H,26,32)(H,27,28,30);4-7,10-12H,2-3,8-9H2,1H3,(H,23,30)(H,24,27)(H,25,26,28);4-9,11H,2-3,10H2,1H3,(H,26,33)(H,27,30)(H,28,29,31);4-11,18H,2-3,25H2,1H3,(H,26,29)(H,27,28,30);3-6,9-10,12,14,23H,7-8,11H2,1-2H3,(H,22,26)(H,24,25,27);4-9,11H,2-3,10H2,1H3,(H,22,25)(H,23,24,26);5-7,11-12,20H,3-4,8-10,21H2,1-2H3,(H,22,23,24)/b;;;;;;;;;20-11+
• InChIKey: ADRHKXOIBMWFQR-XBWGIXDNSA-N
• XLogP: 36.41
• TPSA: 1068.43 Ų
• H-Bond Donors: 29
• H-Bond Acceptors: 69
• Rotatable Bonds: 59
• Heavy Atoms: 318
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4332.79
LogP ≤ 5	36.41
H-Bond Donors ≤ 5	29
H-Bond Acceptors ≤ 10	69

Frequently Asked Questions

What is the IUPAC name of N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine?

The IUPAC name of N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine (CID 157082192) is N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine.

What is the SMILES notation for N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine?

The canonical SMILES for N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine is COc1cc(-c2nc(Nc3ccc4[nH]ncc4c3C3CC3)n(C)n2)ccc1C(=O)NC1CC1.COc1cc(-c2nc(Nc3ccc4[nH]ncc4c3C3CC3)n(C)n2)ccc1C(=O)NC1CCN(CC(F)(F)F)C1.COc1cc(-c2nc(Nc3ccc4[nH]ncc4c3C3CC3)n(C)n2)cnc1C(=O)NC1CC1.Cn1nc(-c2ccc(C(=O)NC3CC3)c(F)c2)nc1Nc1ccc2[nH]ncc2c1C1CC1.Cn1nc(-c2ccc(C(=O)NCC(F)(F)F)nc2)nc1Nc1ccc2[nH]ncc2c1C1CC1.Cn1nc(-c2ccc(C(N)C(F)(F)F)cc2)nc1Nc1ccc2[nH]ncc2c1C1CC1.Cn1nc(-c2ccc(CNS(C)(=O)=O)cc2)nc1Nc1ccc2[nH]ncc2c1C1CC1.Cn1nc(-c2ccc3c(c2)CCNC3=O)nc1Nc1ccc2[nH]ncc2c1C1CC1.Cn1nc(-c2ccc3c(c2)COC3=O)nc1Nc1ccc2[nH]ncc2c1C1CC1.[H]/N=C/c1c(N)ccc(Nc2nc(C3=CCN(C)CC3)nn2C)c1C1CC1.

What is the InChIKey of N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine?

The InChIKey is ADRHKXOIBMWFQR-XBWGIXDNSA-N. The full InChI is InChI=1S/C27H29F3N8O2.C24H25N7O2.C23H22FN7O.C23H24N8O2.C22H21N7O.C21H19F3N8O.C21H20F3N7.C21H23N7O2S.C21H18N6O2.C19H25N7/c1-37-26(33-21-8-7-20-19(12-31-35-20)23(21)15-3-4-15)34-24(36-37)16-5-6-18(22(11-16)40-2)25(39)32-17-9-10-38(13-17)14-27(28,29)30;1-31-24(27-19-10-9-18-17(12-25-29-18)21(19)13-3-4-13)28-22(30-31)14-5-8-16(20(11-14)33-2)23(32)26-15-6-7-15;1-31-23(27-19-9-8-18-16(11-25-29-18)20(19)12-2-3-12)28-21(30-31)13-4-7-15(17(24)10-13)22(32)26-14-5-6-14;1-31-23(27-17-8-7-16-15(11-25-29-16)19(17)12-3-4-12)28-21(30-31)13-9-18(33-2)20(24-10-13)22(32)26-14-5-6-14;1-29-22(25-18-7-6-17-16(11-24-27-17)19(18)12-2-3-12)26-20(28-29)14-4-5-15-13(10-14)8-9-23-21(15)30;1-32-20(28-15-7-6-14-13(9-27-30-14)17(15)11-2-3-11)29-18(31-32)12-4-5-16(25-8-12)19(33)26-10-21(22,23)24;1-31-20(27-16-9-8-15-14(10-26-29-15)17(16)11-2-3-11)28-19(30-31)13-6-4-12(5-7-13)18(25)21(22,23)24;1-28-21(24-18-10-9-17-16(12-22-26-17)19(18)14-7-8-14)25-20(27-28)15-5-3-13(4-6-15)11-23-31(2,29)30;1-27-21(23-17-7-6-16-15(9-22-25-16)18(17)11-2-3-11)24-19(26-27)12-4-5-14-13(8-12)10-29-20(14)28;1-25-9-7-13(8-10-25)18-23-19(26(2)24-18)22-16-6-5-15(21)14(11-20)17(16)12-3-4-12/h5-8,11-12,15,17H,3-4,9-10,13-14H2,1-2H3,(H,31,35)(H,32,39)(H,33,34,36);5,8-13,15H,3-4,6-7H2,1-2H3,(H,25,29)(H,26,32)(H,27,28,30);4,7-12,14H,2-3,5-6H2,1H3,(H,25,29)(H,26,32)(H,27,28,30);7-12,14H,3-6H2,1-2H3,(H,25,29)(H,26,32)(H,27,28,30);4-7,10-12H,2-3,8-9H2,1H3,(H,23,30)(H,24,27)(H,25,26,28);4-9,11H,2-3,10H2,1H3,(H,26,33)(H,27,30)(H,28,29,31);4-11,18H,2-3,25H2,1H3,(H,26,29)(H,27,28,30);3-6,9-10,12,14,23H,7-8,11H2,1-2H3,(H,22,26)(H,24,25,27);4-9,11H,2-3,10H2,1H3,(H,22,25)(H,23,24,26);5-7,11-12,20H,3-4,8-10,21H2,1-2H3,(H,22,23,24)/b;;;;;;;;;20-11+.

What are the key properties of N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine?

N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine has a molecular weight of 4332.79 g/mol, XLogP of 36.41, 59 rotatable bonds, 29 hydrogen bond donors, and 69 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]-2-methyl-1,2,4-triazol-3-yl]-4-cyclopropyl-1H-indazol-5-amine;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-fluorobenzamide;N-cyclopropyl-4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxybenzamide;N-cyclopropyl-5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3-methoxypyridine-2-carboxamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3H-2-benzofuran-1-one;6-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-3,4-dihydro-2H-isoquinolin-1-one;4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-2-methoxy-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]benzamide;N-[[4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]methanesulfonamide;5-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1,2,4-triazol-3-yl]-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide;2-cyclopropyl-3-methanimidoyl-1-N-[2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-triazol-3-yl]benzene-1,4-diamine is sourced from PubChem (CID 157082192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).