N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine

C75H85F10N27O9S4 — CID 159700358

About N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine

N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine (PubChem CID 159700358) has the molecular formula C75H85F10N27O9S4 and a molecular weight of 1826.93 g/mol. Its IUPAC name is N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine.

Molecular Properties

• Compound Name: N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine
• PubChem CID: 159700358
• Molecular Formula: C75H85F10N27O9S4
• Molecular Weight: 1826.93 g/mol
• Exact Mass: 1825.57
• IUPAC Name: N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine
• SMILES: CC1(C)CN(c2cc(-c3cnc4ccc(C(F)F)nn34)ncn2)C[C@H](CNS(C)(=O)=O)O1.CS(=O)(=O)CCN1CCC(c2cc(-c3cnc4ccc(C(F)F)nn34)ncn2)C1.CS(=O)(=O)N1CCC2(CCCCN2c2cc(-c3cnc4ccc(C(F)F)nn34)ncn2)C1.CS(=O)(=O)NCC1CN(c2cc(-c3cnc4ccc(C(F)F)nn34)ncn2)CC(F)(F)C1
• InChI: InChI=1S/C20H23F2N7O2S.C19H23F2N7O3S.C18H19F4N7O2S.C18H20F2N6O2S/c1-32(30,31)27-9-7-20(12-27)6-2-3-8-28(20)18-10-15(24-13-25-18)16-11-23-17-5-4-14(19(21)22)26-29(16)17;1-19(2)10-27(9-12(31-19)7-25-32(3,29)30)17-6-14(23-11-24-17)15-8-22-16-5-4-13(18(20)21)26-28(15)16;1-32(30,31)26-6-11-5-18(21,22)9-28(8-11)16-4-13(24-10-25-16)14-7-23-15-3-2-12(17(19)20)27-29(14)15;1-29(27,28)7-6-25-5-4-12(10-25)14-8-15(23-11-22-14)16-9-21-17-3-2-13(18(19)20)24-26(16)17/h4-5,10-11,13,19H,2-3,6-9,12H2,1H3;4-6,8,11-12,18,25H,7,9-10H2,1-3H3;2-4,7,10-11,17,26H,5-6,8-9H2,1H3;2-3,8-9,11-12,18H,4-7,10H2,1H3/t;12-;;/m.0../s1
• InChIKey: MXNSMAPCQRCXSO-VIFFUBBASA-N
• XLogP: 8.27
• TPSA: 409.93 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 33
• Rotatable Bonds: 22
• Heavy Atoms: 125
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1826.93
LogP ≤ 5	8.27
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	33

Frequently Asked Questions

What is the IUPAC name of N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine?

The IUPAC name of N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine (CID 159700358) is N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine.

What is the SMILES notation for N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine?

The canonical SMILES for N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine is CC1(C)CN(c2cc(-c3cnc4ccc(C(F)F)nn34)ncn2)C[C@H](CNS(C)(=O)=O)O1.CS(=O)(=O)CCN1CCC(c2cc(-c3cnc4ccc(C(F)F)nn34)ncn2)C1.CS(=O)(=O)N1CCC2(CCCCN2c2cc(-c3cnc4ccc(C(F)F)nn34)ncn2)C1.CS(=O)(=O)NCC1CN(c2cc(-c3cnc4ccc(C(F)F)nn34)ncn2)CC(F)(F)C1.

What is the InChIKey of N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine?

The InChIKey is MXNSMAPCQRCXSO-VIFFUBBASA-N. The full InChI is InChI=1S/C20H23F2N7O2S.C19H23F2N7O3S.C18H19F4N7O2S.C18H20F2N6O2S/c1-32(30,31)27-9-7-20(12-27)6-2-3-8-28(20)18-10-15(24-13-25-18)16-11-23-17-5-4-14(19(21)22)26-29(16)17;1-19(2)10-27(9-12(31-19)7-25-32(3,29)30)17-6-14(23-11-24-17)15-8-22-16-5-4-13(18(20)21)26-28(15)16;1-32(30,31)26-6-11-5-18(21,22)9-28(8-11)16-4-13(24-10-25-16)14-7-23-15-3-2-12(17(19)20)27-29(14)15;1-29(27,28)7-6-25-5-4-12(10-25)14-8-15(23-11-22-14)16-9-21-17-3-2-13(18(19)20)24-26(16)17/h4-5,10-11,13,19H,2-3,6-9,12H2,1H3;4-6,8,11-12,18,25H,7,9-10H2,1-3H3;2-4,7,10-11,17,26H,5-6,8-9H2,1H3;2-3,8-9,11-12,18H,4-7,10H2,1H3/t;12-;;/m.0../s1.

What are the key properties of N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine?

N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine has a molecular weight of 1826.93 g/mol, XLogP of 8.27, 22 rotatable bonds, 2 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[1-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-5,5-difluoropiperidin-3-yl]methyl]methanesulfonamide;N-[[(2R)-4-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methyl]methanesulfonamide;6-[6-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]-2-methylsulfonyl-2,6-diazaspiro[4.5]decane;6-(difluoromethyl)-3-[6-[1-(2-methylsulfonylethyl)pyrrolidin-3-yl]pyrimidin-4-yl]imidazo[1,2-b]pyridazine is sourced from PubChem (CID 159700358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).