N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide

C176H170F15N43O6S5 — CID 159637331

About N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide

N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide (PubChem CID 159637331) has the molecular formula C176H170F15N43O6S5 and a molecular weight of 3428.90 g/mol. Its IUPAC name is N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide.

Molecular Properties

• Compound Name: N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide
• PubChem CID: 159637331
• Molecular Formula: C176H170F15N43O6S5
• Molecular Weight: 3428.90 g/mol
• Exact Mass: 3426.27
• IUPAC Name: N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide
• SMILES: C=CC(=O)Nc1ccc(C2(N)CC2n2c(C#N)cc3c(C)c(CN4CCC(Nc5ncnc6sc(CC(F)(F)F)cc56)CC4)ccc32)cn1.C=CC(=O)Nc1ccc(C2(O)CC2n2c(C#N)cc3c(C)c(CN4CCC(Nc5ncnc6sc(CC(F)(F)F)cc56)CC4)ccc32)cn1.C=CC(=O)Nc1ccc(C2C(N)C2n2c(C#N)cc3c(C)c(CN4CCC(Nc5ncnc6sc(CC(F)(F)F)cc56)CC4)ccc32)cc1.C=CC(=O)Nc1ccc(C2C(N)C2n2c(C#N)cc3c(C)c(CN4CCC(Nc5ncnc6sc(CC(F)(F)F)cc56)CC4)ccc32)cn1.C=CC(=O)Nc1ccc(C2C(N)C2n2c(C#N)cc3c(C)c(CN4CCC(Nc5ncnc6sc(CC(F)(F)F)cc56)CC4)ccc32)nc1
• InChI: InChI=1S/C36H35F3N8OS.3C35H34F3N9OS.C35H33F3N8O2S/c1-3-30(48)44-23-7-4-21(5-8-23)31-32(41)33(31)47-25(17-40)14-27-20(2)22(6-9-29(27)47)18-46-12-10-24(11-13-46)45-34-28-15-26(16-36(37,38)39)49-35(28)43-19-42-34;1-3-29(48)44-22-5-6-27(41-16-22)30-31(40)32(30)47-23(15-39)12-25-19(2)20(4-7-28(25)47)17-46-10-8-21(9-11-46)45-33-26-13-24(14-35(36,37)38)49-34(26)43-18-42-33;1-3-31(48)45-30-7-5-22(17-41-30)34(40)15-29(34)47-24(16-39)12-26-20(2)21(4-6-28(26)47)18-46-10-8-23(9-11-46)44-32-27-13-25(14-35(36,37)38)49-33(27)43-19-42-32;1-3-29(48)45-28-7-5-20(16-41-28)30-31(40)32(30)47-23(15-39)12-25-19(2)21(4-6-27(25)47)17-46-10-8-22(9-11-46)44-33-26-13-24(14-35(36,37)38)49-34(26)43-18-42-33;1-3-31(47)44-30-7-5-22(17-40-30)34(48)15-29(34)46-24(16-39)12-26-20(2)21(4-6-28(26)46)18-45-10-8-23(9-11-45)43-32-27-13-25(14-35(36,37)38)49-33(27)42-19-41-32/h3-9,14-15,19,24,31-33H,1,10-13,16,18,41H2,2H3,(H,44,48)(H,42,43,45);3-7,12-13,16,18,21,30-32H,1,8-11,14,17,40H2,2H3,(H,44,48)(H,42,43,45);3-7,12-13,17,19,23,29H,1,8-11,14-15,18,40H2,2H3,(H,41,45,48)(H,42,43,44);3-7,12-13,16,18,22,30-32H,1,8-11,14,17,40H2,2H3,(H,41,45,48)(H,42,43,44);3-7,12-13,17,19,23,29,48H,1,8-11,14-15,18H2,2H3,(H,40,44,47)(H,41,42,43)
• InChIKey: MPXIGVUVEXXOLK-UHFFFAOYSA-N
• XLogP: 31.87
• TPSA: 670.22 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 49
• Rotatable Bonds: 45
• Heavy Atoms: 245
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3428.90
LogP ≤ 5	31.87
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	49

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide?

The IUPAC name of N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide (CID 159637331) is N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide.

What is the SMILES notation for N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide?

The canonical SMILES for N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide is C=CC(=O)Nc1ccc(C2(N)CC2n2c(C#N)cc3c(C)c(CN4CCC(Nc5ncnc6sc(CC(F)(F)F)cc56)CC4)ccc32)cn1.C=CC(=O)Nc1ccc(C2(O)CC2n2c(C#N)cc3c(C)c(CN4CCC(Nc5ncnc6sc(CC(F)(F)F)cc56)CC4)ccc32)cn1.C=CC(=O)Nc1ccc(C2C(N)C2n2c(C#N)cc3c(C)c(CN4CCC(Nc5ncnc6sc(CC(F)(F)F)cc56)CC4)ccc32)cc1.C=CC(=O)Nc1ccc(C2C(N)C2n2c(C#N)cc3c(C)c(CN4CCC(Nc5ncnc6sc(CC(F)(F)F)cc56)CC4)ccc32)cn1.C=CC(=O)Nc1ccc(C2C(N)C2n2c(C#N)cc3c(C)c(CN4CCC(Nc5ncnc6sc(CC(F)(F)F)cc56)CC4)ccc32)nc1.

What is the InChIKey of N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide?

The InChIKey is MPXIGVUVEXXOLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H35F3N8OS.3C35H34F3N9OS.C35H33F3N8O2S/c1-3-30(48)44-23-7-4-21(5-8-23)31-32(41)33(31)47-25(17-40)14-27-20(2)22(6-9-29(27)47)18-46-12-10-24(11-13-46)45-34-28-15-26(16-36(37,38)39)49-35(28)43-19-42-34;1-3-29(48)44-22-5-6-27(41-16-22)30-31(40)32(30)47-23(15-39)12-25-19(2)20(4-7-28(25)47)17-46-10-8-21(9-11-46)45-33-26-13-24(14-35(36,37)38)49-34(26)43-18-42-33;1-3-31(48)45-30-7-5-22(17-41-30)34(40)15-29(34)47-24(16-39)12-26-20(2)21(4-6-28(26)47)18-46-10-8-23(9-11-46)44-32-27-13-25(14-35(36,37)38)49-33(27)43-19-42-32;1-3-29(48)45-28-7-5-20(16-41-28)30-31(40)32(30)47-23(15-39)12-25-19(2)21(4-6-27(25)47)17-46-10-8-22(9-11-46)44-33-26-13-24(14-35(36,37)38)49-34(26)43-18-42-33;1-3-31(47)44-30-7-5-22(17-40-30)34(48)15-29(34)46-24(16-39)12-26-20(2)21(4-6-28(26)46)18-45-10-8-23(9-11-45)43-32-27-13-25(14-35(36,37)38)49-33(27)42-19-41-32/h3-9,14-15,19,24,31-33H,1,10-13,16,18,41H2,2H3,(H,44,48)(H,42,43,45);3-7,12-13,16,18,21,30-32H,1,8-11,14,17,40H2,2H3,(H,44,48)(H,42,43,45);3-7,12-13,17,19,23,29H,1,8-11,14-15,18,40H2,2H3,(H,41,45,48)(H,42,43,44);3-7,12-13,16,18,22,30-32H,1,8-11,14,17,40H2,2H3,(H,41,45,48)(H,42,43,44);3-7,12-13,17,19,23,29,48H,1,8-11,14-15,18H2,2H3,(H,40,44,47)(H,41,42,43).

What are the key properties of N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide?

N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide has a molecular weight of 3428.90 g/mol, XLogP of 31.87, 45 rotatable bonds, 15 hydrogen bond donors, and 49 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]phenyl]prop-2-enamide;N-[5-[1-amino-2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[5-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-2-pyridinyl]prop-2-enamide;N-[6-[2-amino-3-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]cyclopropyl]-3-pyridinyl]prop-2-enamide;N-[5-[2-[2-cyano-4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]indol-1-yl]-1-hydroxycyclopropyl]-2-pyridinyl]prop-2-enamide is sourced from PubChem (CID 159637331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).