4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine

C71H69F3N16O6S — CID 159801504

About 4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine

4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine (PubChem CID 159801504) has the molecular formula C71H69F3N16O6S and a molecular weight of 1331.50 g/mol. Its IUPAC name is 4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine.

Molecular Properties

• Compound Name: 4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine
• PubChem CID: 159801504
• Molecular Formula: C71H69F3N16O6S
• Molecular Weight: 1331.50 g/mol
• Exact Mass: 1330.53
• IUPAC Name: 4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine
• SMILES: Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(N4CCOCC4)cc3C)c2n1.Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(S(=O)(=O)N(C)C)cc3)c2n1.Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccncn3)c2n1
• InChI: InChI=1S/C27H28FN5O2.C24H24FN5O3S.C20H17FN6O/c1-17-13-19(32-8-11-34-12-9-32)3-4-20(17)23-15-30-27(33-16-18(2)31-26(23)33)29-14-22-21-7-10-35-25(21)6-5-24(22)28;1-15-14-30-23(28-15)19(16-4-6-17(7-5-16)34(31,32)29(2)3)12-26-24(30)27-13-20-18-10-11-33-22(18)9-8-21(20)25;1-12-10-27-19(26-12)15(17-4-6-22-11-25-17)9-24-20(27)23-8-14-13-5-7-28-18(13)3-2-16(14)21/h3-6,13,15-16H,7-12,14H2,1-2H3,(H,29,30);4-9,12,14H,10-11,13H2,1-3H3,(H,26,27);2-4,6,9-11H,5,7-8H2,1H3,(H,23,24)
• InChIKey: NJVUHOXIELZMGM-UHFFFAOYSA-N
• XLogP: 11.36
• TPSA: 229.98 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 21
• Rotatable Bonds: 15
• Heavy Atoms: 97
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1331.50
LogP ≤ 5	11.36
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine?

The IUPAC name of 4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine (CID 159801504) is 4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine.

What is the SMILES notation for 4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine?

The canonical SMILES for 4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine is Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(N4CCOCC4)cc3C)c2n1.Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(S(=O)(=O)N(C)C)cc3)c2n1.Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccncn3)c2n1.

What is the InChIKey of 4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine?

The InChIKey is NJVUHOXIELZMGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28FN5O2.C24H24FN5O3S.C20H17FN6O/c1-17-13-19(32-8-11-34-12-9-32)3-4-20(17)23-15-30-27(33-16-18(2)31-26(23)33)29-14-22-21-7-10-35-25(21)6-5-24(22)28;1-15-14-30-23(28-15)19(16-4-6-17(7-5-16)34(31,32)29(2)3)12-26-24(30)27-13-20-18-10-11-33-22(18)9-8-21(20)25;1-12-10-27-19(26-12)15(17-4-6-22-11-25-17)9-24-20(27)23-8-14-13-5-7-28-18(13)3-2-16(14)21/h3-6,13,15-16H,7-12,14H2,1-2H3,(H,29,30);4-9,12,14H,10-11,13H2,1-3H3,(H,26,27);2-4,6,9-11H,5,7-8H2,1H3,(H,23,24).

What are the key properties of 4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine?

4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine has a molecular weight of 1331.50 g/mol, XLogP of 11.36, 15 rotatable bonds, 3 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzenesulfonamide;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-(2-methyl-4-morpholin-4-ylphenyl)imidazo[1,2-c]pyrimidin-5-amine;N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-2-methyl-8-pyrimidin-4-ylimidazo[1,2-c]pyrimidin-5-amine is sourced from PubChem (CID 159801504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).