3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one

C76H92F3N15O9S3 — CID 157139149

About 3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one

3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one (PubChem CID 157139149) has the molecular formula C76H92F3N15O9S3 and a molecular weight of 1512.86 g/mol. Its IUPAC name is 3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one.

Molecular Properties

• Compound Name: 3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one
• PubChem CID: 157139149
• Molecular Formula: C76H92F3N15O9S3
• Molecular Weight: 1512.86 g/mol
• Exact Mass: 1511.63
• IUPAC Name: 3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one
• SMILES: CC1CN(c2c[nH]c3ccccc23)CCN1S(C)(=O)=O.CS(=O)(=O)N1CCCC(c2c[nH]c3cc(F)ccc23)CC1.Cc1ccc2c(c1)C(C1CCN(S(C)(=O)=O)CC1)C(=O)N2.Cc1nc(N2CCC(c3c[nH]c4cc(F)ccc34)CC2)no1.Cc1noc(N2CCC(c3c[nH]c4cc(F)ccc34)CC2)n1
• InChI: InChI=1S/2C16H17FN4O.C15H19FN2O2S.C15H20N2O3S.C14H19N3O2S/c1-10-19-16(20-22-10)21-6-4-11(5-7-21)14-9-18-15-8-12(17)2-3-13(14)15;1-10-19-16(22-20-10)21-6-4-11(5-7-21)14-9-18-15-8-12(17)2-3-13(14)15;1-21(19,20)18-7-2-3-11(6-8-18)14-10-17-15-9-12(16)4-5-13(14)15;1-10-3-4-13-12(9-10)14(15(18)16-13)11-5-7-17(8-6-11)21(2,19)20;1-11-10-16(7-8-17(11)20(2,18)19)14-9-15-13-6-4-3-5-12(13)14/h2*2-3,8-9,11,18H,4-7H2,1H3;4-5,9-11,17H,2-3,6-8H2,1H3;3-4,9,11,14H,5-8H2,1-2H3,(H,16,18);3-6,9,11,15H,7-8,10H2,1-2H3
• InChIKey: AJZFYTJCYNEFSG-UHFFFAOYSA-N
• XLogP: 12.94
• TPSA: 291.96 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 16
• Rotatable Bonds: 10
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1512.86
LogP ≤ 5	12.94
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one?

The IUPAC name of 3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one (CID 157139149) is 3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one.

What is the SMILES notation for 3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one?

The canonical SMILES for 3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one is CC1CN(c2c[nH]c3ccccc23)CCN1S(C)(=O)=O.CS(=O)(=O)N1CCCC(c2c[nH]c3cc(F)ccc23)CC1.Cc1ccc2c(c1)C(C1CCN(S(C)(=O)=O)CC1)C(=O)N2.Cc1nc(N2CCC(c3c[nH]c4cc(F)ccc34)CC2)no1.Cc1noc(N2CCC(c3c[nH]c4cc(F)ccc34)CC2)n1.

What is the InChIKey of 3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one?

The InChIKey is AJZFYTJCYNEFSG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C16H17FN4O.C15H19FN2O2S.C15H20N2O3S.C14H19N3O2S/c1-10-19-16(20-22-10)21-6-4-11(5-7-21)14-9-18-15-8-12(17)2-3-13(14)15;1-10-19-16(22-20-10)21-6-4-11(5-7-21)14-9-18-15-8-12(17)2-3-13(14)15;1-21(19,20)18-7-2-3-11(6-8-18)14-10-17-15-9-12(16)4-5-13(14)15;1-10-3-4-13-12(9-10)14(15(18)16-13)11-5-7-17(8-6-11)21(2,19)20;1-11-10-16(7-8-17(11)20(2,18)19)14-9-15-13-6-4-3-5-12(13)14/h2*2-3,8-9,11,18H,4-7H2,1H3;4-5,9-11,17H,2-3,6-8H2,1H3;3-4,9,11,14H,5-8H2,1-2H3,(H,16,18);3-6,9,11,15H,7-8,10H2,1-2H3.

What are the key properties of 3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one?

3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one has a molecular weight of 1512.86 g/mol, XLogP of 12.94, 10 rotatable bonds, 5 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-5-methyl-1,2,4-oxadiazole;5-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]-3-methyl-1,2,4-oxadiazole;6-fluoro-3-(1-methylsulfonylazepan-4-yl)-1H-indole;3-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indole;5-methyl-3-(1-methylsulfonylpiperidin-4-yl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 157139149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).