[8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol

C91H86F4N20O10S — CID 167562040

About [8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol

[8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol (PubChem CID 167562040) has the molecular formula C91H86F4N20O10S and a molecular weight of 1727.88 g/mol. Its IUPAC name is [8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol.

Molecular Properties

• Compound Name: [8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol
• PubChem CID: 167562040
• Molecular Formula: C91H86F4N20O10S
• Molecular Weight: 1727.88 g/mol
• Exact Mass: 1726.65
• IUPAC Name: [8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol
• SMILES: Cc1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cc(CO)nc23)n(C)n1.Cc1cc(S(C)(=O)=O)ccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cc(CO)nc12.Cc1ncccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cc(CO)nc12.OCc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(C4CC4)nc3)c2n1
• InChI: InChI=1S/C24H22FN5O2.C24H23FN4O4S.C22H20FN5O2.C21H21FN6O2/c25-20-4-6-22-17(7-8-32-22)19(20)11-28-24-27-10-18(23-29-16(13-31)12-30(23)24)15-3-5-21(26-9-15)14-1-2-14;1-14-9-16(34(2,31)32)3-4-17(14)20-11-27-24(29-12-15(13-30)28-23(20)29)26-10-19-18-7-8-33-22(18)6-5-21(19)25;1-13-15(3-2-7-24-13)18-10-26-22(28-11-14(12-29)27-21(18)28)25-9-17-16-6-8-30-20(16)5-4-19(17)23;1-12-7-18(27(2)26-12)16-9-24-21(28-10-13(11-29)25-20(16)28)23-8-15-14-5-6-30-19(14)4-3-17(15)22/h3-6,9-10,12,14,31H,1-2,7-8,11,13H2,(H,27,28);3-6,9,11-12,30H,7-8,10,13H2,1-2H3,(H,26,27);2-5,7,10-11,29H,6,8-9,12H2,1H3,(H,25,26);3-4,7,9-10,29H,5-6,8,11H2,1-2H3,(H,23,24)
• InChIKey: DUCKJMCAZSYTHL-UHFFFAOYSA-N
• XLogP: 13.03
• TPSA: 364.46 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 30
• Rotatable Bonds: 22
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1727.88
LogP ≤ 5	13.03
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of [8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol?

The IUPAC name of [8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol (CID 167562040) is [8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol.

What is the SMILES notation for [8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol?

The canonical SMILES for [8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol is Cc1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cc(CO)nc23)n(C)n1.Cc1cc(S(C)(=O)=O)ccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cc(CO)nc12.Cc1ncccc1-c1cnc(NCc2c(F)ccc3c2CCO3)n2cc(CO)nc12.OCc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(C4CC4)nc3)c2n1.

What is the InChIKey of [8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol?

The InChIKey is DUCKJMCAZSYTHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22FN5O2.C24H23FN4O4S.C22H20FN5O2.C21H21FN6O2/c25-20-4-6-22-17(7-8-32-22)19(20)11-28-24-27-10-18(23-29-16(13-31)12-30(23)24)15-3-5-21(26-9-15)14-1-2-14;1-14-9-16(34(2,31)32)3-4-17(14)20-11-27-24(29-12-15(13-30)28-23(20)29)26-10-19-18-7-8-33-22(18)6-5-21(19)25;1-13-15(3-2-7-24-13)18-10-26-22(28-11-14(12-29)27-21(18)28)25-9-17-16-6-8-30-20(16)5-4-19(17)23;1-12-7-18(27(2)26-12)16-9-24-21(28-10-13(11-29)25-20(16)28)23-8-15-14-5-6-30-19(14)4-3-17(15)22/h3-6,9-10,12,14,31H,1-2,7-8,11,13H2,(H,27,28);3-6,9,11-12,30H,7-8,10,13H2,1-2H3,(H,26,27);2-5,7,10-11,29H,6,8-9,12H2,1H3,(H,25,26);3-4,7,9-10,29H,5-6,8,11H2,1-2H3,(H,23,24).

What are the key properties of [8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol?

[8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol has a molecular weight of 1727.88 g/mol, XLogP of 13.03, 22 rotatable bonds, 8 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for [8-(6-cyclopropyl-3-pyridinyl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-4-methylsulfonylphenyl)imidazo[1,2-c]pyrimidin-2-yl]methanol;[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-8-(2-methyl-3-pyridinyl)imidazo[1,2-c]pyrimidin-2-yl]methanol is sourced from PubChem (CID 167562040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).