N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine

C204H232F29N49O — CID 159079625

About N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine

N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine (PubChem CID 159079625) has the molecular formula C204H232F29N49O and a molecular weight of 3937.38 g/mol. Its IUPAC name is N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine.

Molecular Properties

• Compound Name: N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine
• PubChem CID: 159079625
• Molecular Formula: C204H232F29N49O
• Molecular Weight: 3937.38 g/mol
• Exact Mass: 3934.91
• IUPAC Name: N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine
• SMILES: COCCN1CCC(C(C)c2ccc(Nc3ncc(F)c(-c4cc(F)c5nc(C)n(C(C)C)c5c4)n3)nc2)CC1.Cc1nc2c(F)cc(-c3nc(Nc4ccc(C(C)C5CCN(CC(F)(F)F)CC5)cn4)ncc3F)cc2n1C(C)C.Cc1nc2c(F)cc(-c3nc(Nc4ccc(C(C)C5CCN(CC(F)F)CC5)cn4)ncc3F)cc2n1C(C)C.Cc1nc2c(F)cc(-c3nc(Nc4ccc([C@@H](C)C5CCN(CC(F)(F)F)CC5)cn4)ncc3F)cc2n1C(C)C.Cc1nc2c(F)cc(-c3nc(Nc4ccc([C@@H](C)C5CCN(CC(F)F)CC5)cn4)ncc3F)cc2n1C(C)C.Cc1nc2c(F)cc(-c3nc(Nc4ccc([C@H](C)C5CCN(CC(F)(F)F)CC5)cn4)ncc3F)cc2n1C(C)C.Cc1nc2c(F)cc(-c3nc(Nc4ccc([C@H](C)C5CCN(CC(F)F)CC5)cn4)ncc3F)cc2n1C(C)C
• InChI: InChI=1S/C30H37F2N7O.3C29H32F5N7.3C29H33F4N7/c1-18(2)39-20(4)35-29-24(31)14-23(15-26(29)39)28-25(32)17-34-30(37-28)36-27-7-6-22(16-33-27)19(3)21-8-10-38(11-9-21)12-13-40-5;3*1-16(2)41-18(4)37-27-22(30)11-21(12-24(27)41)26-23(31)14-36-28(39-26)38-25-6-5-20(13-35-25)17(3)19-7-9-40(10-8-19)15-29(32,33)34;3*1-16(2)40-18(4)36-28-22(30)11-21(12-24(28)40)27-23(31)14-35-29(38-27)37-26-6-5-20(13-34-26)17(3)19-7-9-39(10-8-19)15-25(32)33/h6-7,14-19,21H,8-13H2,1-5H3,(H,33,34,36,37);3*5-6,11-14,16-17,19H,7-10,15H2,1-4H3,(H,35,36,38,39);3*5-6,11-14,16-17,19,25H,7-10,15H2,1-4H3,(H,34,35,37,38)/t;2*17-;;2*17-;/m.10.10./s1
• InChIKey: KARQFSIRJUMESD-SLUATSJZSA-N
• XLogP: 48.43
• TPSA: 511.55 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 50
• Rotatable Bonds: 54
• Heavy Atoms: 283
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3937.38
LogP ≤ 5	48.43
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	50

Frequently Asked Questions

What is the IUPAC name of N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine?

The IUPAC name of N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine (CID 159079625) is N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine.

What is the SMILES notation for N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine?

The canonical SMILES for N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine is COCCN1CCC(C(C)c2ccc(Nc3ncc(F)c(-c4cc(F)c5nc(C)n(C(C)C)c5c4)n3)nc2)CC1.Cc1nc2c(F)cc(-c3nc(Nc4ccc(C(C)C5CCN(CC(F)(F)F)CC5)cn4)ncc3F)cc2n1C(C)C.Cc1nc2c(F)cc(-c3nc(Nc4ccc(C(C)C5CCN(CC(F)F)CC5)cn4)ncc3F)cc2n1C(C)C.Cc1nc2c(F)cc(-c3nc(Nc4ccc([C@@H](C)C5CCN(CC(F)(F)F)CC5)cn4)ncc3F)cc2n1C(C)C.Cc1nc2c(F)cc(-c3nc(Nc4ccc([C@@H](C)C5CCN(CC(F)F)CC5)cn4)ncc3F)cc2n1C(C)C.Cc1nc2c(F)cc(-c3nc(Nc4ccc([C@H](C)C5CCN(CC(F)(F)F)CC5)cn4)ncc3F)cc2n1C(C)C.Cc1nc2c(F)cc(-c3nc(Nc4ccc([C@H](C)C5CCN(CC(F)F)CC5)cn4)ncc3F)cc2n1C(C)C.

What is the InChIKey of N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine?

The InChIKey is KARQFSIRJUMESD-SLUATSJZSA-N. The full InChI is InChI=1S/C30H37F2N7O.3C29H32F5N7.3C29H33F4N7/c1-18(2)39-20(4)35-29-24(31)14-23(15-26(29)39)28-25(32)17-34-30(37-28)36-27-7-6-22(16-33-27)19(3)21-8-10-38(11-9-21)12-13-40-5;3*1-16(2)41-18(4)37-27-22(30)11-21(12-24(27)41)26-23(31)14-36-28(39-26)38-25-6-5-20(13-35-25)17(3)19-7-9-40(10-8-19)15-29(32,33)34;3*1-16(2)40-18(4)36-28-22(30)11-21(12-24(28)40)27-23(31)14-35-29(38-27)37-26-6-5-20(13-34-26)17(3)19-7-9-39(10-8-19)15-25(32)33/h6-7,14-19,21H,8-13H2,1-5H3,(H,33,34,36,37);3*5-6,11-14,16-17,19H,7-10,15H2,1-4H3,(H,35,36,38,39);3*5-6,11-14,16-17,19,25H,7-10,15H2,1-4H3,(H,34,35,37,38)/t;2*17-;;2*17-;/m.10.10./s1.

What are the key properties of N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine?

N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine has a molecular weight of 3937.38 g/mol, XLogP of 48.43, 54 rotatable bonds, 7 hydrogen bond donors, and 50 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[(1R)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-[1-(2,2-difluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2-methoxyethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1R)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[(1S)-1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine;5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)-N-[5-[1-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]-2-pyridinyl]pyrimidin-2-amine is sourced from PubChem (CID 159079625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).