2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine

C346H482N40O15S9 — CID 167631307

About 2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine

2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine (PubChem CID 167631307) has the molecular formula C346H482N40O15S9 and a molecular weight of 5730.53 g/mol. Its IUPAC name is 2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine.

Molecular Properties

• Compound Name: 2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine
• PubChem CID: 167631307
• Molecular Formula: C346H482N40O15S9
• Molecular Weight: 5730.53 g/mol
• Exact Mass: 5725.57
• IUPAC Name: 2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine
• SMILES: C#Cc1cc(COc2cc(-c3cnc(C4CCN(C(C)(C)C)CC4)s3)cnc2N)c(C(C)(C)C)c(C(C)(C)C)n1.CC(C)(C)c1cc(C#CC(C)(C)C2CCCCC2)cc(COc2cc(-c3cnc(C4CCN(C(C)(C)C)CC4)s3)cnc2N)c1C(C)(C)C.CC(C)(C)c1cc(C#CC2(O)CCCC2=O)cc(COc2cc(-c3cnc(C4CCN(C(C)(C)C)CC4)s3)cnc2N)c1C(C)(C)C.CC1(C#Cc2cc(COc3cc(-c4cnc(C5CCN(C(C)(C)C)CC5)s4)cnc3N)c(C(C)(C)C)c(C(C)(C)C)c2)CCC1.CC1(C#Cc2cc(COc3cc(-c4cnc(C5CCN(C(C)(C)C)CC5)s4)cnc3N)c(C(C)(C)C)c(C(C)(C)C)c2)CCCC1.CC1(C#Cc2cc(COc3cc(-c4cnc(C5CCN(C(C)(C)C)CC5)s4)cnc3N)c(C(C)(C)C)c(C(C)(C)C)c2)CCCCC1.CN1CCC(O)(C#Cc2cc(COc3cc(-c4cnc(C5CCN(C(C)(C)C)CC5)s4)cnc3N)c(C(C)(C)C)c(C(C)(C)C)c2)C1=O.CN1CCCC(O)(C#Cc2cc(COc3cc(-c4cnc(C5CCN(C(C)(C)C)CC5)s4)cnc3N)c(C(C)(C)C)c(C(C)(C)C)c2)C1=O.Cc1cc(COc2cc(-c3cnc(C4CCN(C(C)(C)C)CC4)s3)cnc2N)c(C(C)(C)C)c(C(C)(C)C)n1
• InChI: InChI=1S/C43H62N4OS.C41H58N4OS.C40H55N5O3S.C40H56N4OS.C39H53N5O3S.C39H52N4O3S.C39H54N4OS.C33H45N5OS.C32H47N5OS/c1-40(2,3)34-24-29(17-20-43(10,11)33-15-13-12-14-16-33)23-32(37(34)41(4,5)6)28-48-35-25-31(26-45-38(35)44)36-27-46-39(49-36)30-18-21-47(22-19-30)42(7,8)9;1-38(2,3)32-23-28(14-19-41(10)17-12-11-13-18-41)22-31(35(32)39(4,5)6)27-46-33-24-30(25-43-36(33)42)34-26-44-37(47-34)29-15-20-45(21-16-29)40(7,8)9;1-37(2,3)30-21-26(12-16-40(47)15-11-17-44(10)36(40)46)20-29(33(30)38(4,5)6)25-48-31-22-28(23-42-34(31)41)32-24-43-35(49-32)27-13-18-45(19-14-27)39(7,8)9;1-37(2,3)31-22-27(13-18-40(10)16-11-12-17-40)21-30(34(31)38(4,5)6)26-45-32-23-29(24-42-35(32)41)33-25-43-36(46-33)28-14-19-44(20-15-28)39(7,8)9;1-36(2,3)29-20-25(11-14-39(46)15-18-43(10)35(39)45)19-28(32(29)37(4,5)6)24-47-30-21-27(22-41-33(30)40)31-23-42-34(48-31)26-12-16-44(17-13-26)38(7,8)9;1-36(2,3)29-20-25(12-16-39(45)15-10-11-32(39)44)19-28(33(29)37(4,5)6)24-46-30-21-27(22-41-34(30)40)31-23-42-35(47-31)26-13-17-43(18-14-26)38(7,8)9;1-36(2,3)30-21-26(12-17-39(10)15-11-16-39)20-29(33(30)37(4,5)6)25-44-31-22-28(23-41-34(31)40)32-24-42-35(45-32)27-13-18-43(19-14-27)38(7,8)9;1-11-24-16-23(27(31(2,3)4)28(37-24)32(5,6)7)20-39-25-17-22(18-35-29(25)34)26-19-36-30(40-26)21-12-14-38(15-13-21)33(8,9)10;1-20-15-23(26(30(2,3)4)27(36-20)31(5,6)7)19-38-24-16-22(17-34-28(24)33)25-18-35-29(39-25)21-11-13-37(14-12-21)32(8,9)10/h23-27,30,33H,12-16,18-19,21-22,28H2,1-11H3,(H2,44,45);22-26,29H,11-13,15-18,20-21,27H2,1-10H3,(H2,42,43);20-24,27,47H,11,13-15,17-19,25H2,1-10H3,(H2,41,42);21-25,28H,11-12,14-17,19-20,26H2,1-10H3,(H2,41,42);19-23,26,46H,12-13,15-18,24H2,1-10H3,(H2,40,41);19-23,26,45H,10-11,13-15,17-18,24H2,1-9H3,(H2,40,41);20-24,27H,11,13-16,18-19,25H2,1-10H3,(H2,40,41);1,16-19,21H,12-15,20H2,2-10H3,(H2,34,35);15-18,21H,11-14,19H2,1-10H3,(H2,33,34)
• InChIKey: NVNTUYSFCXIHRY-UHFFFAOYSA-N
• XLogP: 77.40
• TPSA: 722.59 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 62
• Rotatable Bonds: 46
• Heavy Atoms: 410
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	5730.53
LogP ≤ 5	77.40
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	62

Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine?

The IUPAC name of 2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine (CID 167631307) is 2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine.

What is the SMILES notation for 2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine?

The canonical SMILES for 2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine is C#Cc1cc(COc2cc(-c3cnc(C4CCN(C(C)(C)C)CC4)s3)cnc2N)c(C(C)(C)C)c(C(C)(C)C)n1.CC(C)(C)c1cc(C#CC(C)(C)C2CCCCC2)cc(COc2cc(-c3cnc(C4CCN(C(C)(C)C)CC4)s3)cnc2N)c1C(C)(C)C.CC(C)(C)c1cc(C#CC2(O)CCCC2=O)cc(COc2cc(-c3cnc(C4CCN(C(C)(C)C)CC4)s3)cnc2N)c1C(C)(C)C.CC1(C#Cc2cc(COc3cc(-c4cnc(C5CCN(C(C)(C)C)CC5)s4)cnc3N)c(C(C)(C)C)c(C(C)(C)C)c2)CCC1.CC1(C#Cc2cc(COc3cc(-c4cnc(C5CCN(C(C)(C)C)CC5)s4)cnc3N)c(C(C)(C)C)c(C(C)(C)C)c2)CCCC1.CC1(C#Cc2cc(COc3cc(-c4cnc(C5CCN(C(C)(C)C)CC5)s4)cnc3N)c(C(C)(C)C)c(C(C)(C)C)c2)CCCCC1.CN1CCC(O)(C#Cc2cc(COc3cc(-c4cnc(C5CCN(C(C)(C)C)CC5)s4)cnc3N)c(C(C)(C)C)c(C(C)(C)C)c2)C1=O.CN1CCCC(O)(C#Cc2cc(COc3cc(-c4cnc(C5CCN(C(C)(C)C)CC5)s4)cnc3N)c(C(C)(C)C)c(C(C)(C)C)c2)C1=O.Cc1cc(COc2cc(-c3cnc(C4CCN(C(C)(C)C)CC4)s3)cnc2N)c(C(C)(C)C)c(C(C)(C)C)n1.

What is the InChIKey of 2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine?

The InChIKey is NVNTUYSFCXIHRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H62N4OS.C41H58N4OS.C40H55N5O3S.C40H56N4OS.C39H53N5O3S.C39H52N4O3S.C39H54N4OS.C33H45N5OS.C32H47N5OS/c1-40(2,3)34-24-29(17-20-43(10,11)33-15-13-12-14-16-33)23-32(37(34)41(4,5)6)28-48-35-25-31(26-45-38(35)44)36-27-46-39(49-36)30-18-21-47(22-19-30)42(7,8)9;1-38(2,3)32-23-28(14-19-41(10)17-12-11-13-18-41)22-31(35(32)39(4,5)6)27-46-33-24-30(25-43-36(33)42)34-26-44-37(47-34)29-15-20-45(21-16-29)40(7,8)9;1-37(2,3)30-21-26(12-16-40(47)15-11-17-44(10)36(40)46)20-29(33(30)38(4,5)6)25-48-31-22-28(23-42-34(31)41)32-24-43-35(49-32)27-13-18-45(19-14-27)39(7,8)9;1-37(2,3)31-22-27(13-18-40(10)16-11-12-17-40)21-30(34(31)38(4,5)6)26-45-32-23-29(24-42-35(32)41)33-25-43-36(46-33)28-14-19-44(20-15-28)39(7,8)9;1-36(2,3)29-20-25(11-14-39(46)15-18-43(10)35(39)45)19-28(32(29)37(4,5)6)24-47-30-21-27(22-41-33(30)40)31-23-42-34(48-31)26-12-16-44(17-13-26)38(7,8)9;1-36(2,3)29-20-25(12-16-39(45)15-10-11-32(39)44)19-28(33(29)37(4,5)6)24-46-30-21-27(22-41-34(30)40)31-23-42-35(47-31)26-13-17-43(18-14-26)38(7,8)9;1-36(2,3)30-21-26(12-17-39(10)15-11-16-39)20-29(33(30)37(4,5)6)25-44-31-22-28(23-41-34(31)40)32-24-42-35(45-32)27-13-18-43(19-14-27)38(7,8)9;1-11-24-16-23(27(31(2,3)4)28(37-24)32(5,6)7)20-39-25-17-22(18-35-29(25)34)26-19-36-30(40-26)21-12-14-38(15-13-21)33(8,9)10;1-20-15-23(26(30(2,3)4)27(36-20)31(5,6)7)19-38-24-16-22(17-34-28(24)33)25-18-35-29(39-25)21-11-13-37(14-12-21)32(8,9)10/h23-27,30,33H,12-16,18-19,21-22,28H2,1-11H3,(H2,44,45);22-26,29H,11-13,15-18,20-21,27H2,1-10H3,(H2,42,43);20-24,27,47H,11,13-15,17-19,25H2,1-10H3,(H2,41,42);21-25,28H,11-12,14-17,19-20,26H2,1-10H3,(H2,41,42);19-23,26,46H,12-13,15-18,24H2,1-10H3,(H2,40,41);19-23,26,45H,10-11,13-15,17-18,24H2,1-9H3,(H2,40,41);20-24,27H,11,13-16,18-19,25H2,1-10H3,(H2,40,41);1,16-19,21H,12-15,20H2,2-10H3,(H2,34,35);15-18,21H,11-14,19H2,1-10H3,(H2,33,34).

What are the key properties of 2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine?

2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine has a molecular weight of 5730.53 g/mol, XLogP of 77.40, 46 rotatable bonds, 12 hydrogen bond donors, and 62 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-2-hydroxycyclopentan-1-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpiperidin-2-one;3-[2-[3-[[2-amino-5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-pyridinyl]oxymethyl]-4,5-ditert-butylphenyl]ethynyl]-3-hydroxy-1-methylpyrrolidin-2-one;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-(3-cyclohexyl-3-methylbut-1-ynyl)phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-ethynyl-4-pyridinyl)methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclobutyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclohexyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[[2,3-ditert-butyl-5-[2-(1-methylcyclopentyl)ethynyl]phenyl]methoxy]pyridin-2-amine;5-[2-(1-tert-butylpiperidin-4-yl)-1,3-thiazol-5-yl]-3-[(2,3-ditert-butyl-6-methyl-4-pyridinyl)methoxy]pyridin-2-amine is sourced from PubChem (CID 167631307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).