N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone

C72H90F6N10O8S — CID 158211294

About N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone

N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone (PubChem CID 158211294) has the molecular formula C72H90F6N10O8S and a molecular weight of 1369.63 g/mol. Its IUPAC name is N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone.

Molecular Properties

• Compound Name: N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone
• PubChem CID: 158211294
• Molecular Formula: C72H90F6N10O8S
• Molecular Weight: 1369.63 g/mol
• Exact Mass: 1368.66
• IUPAC Name: N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone
• SMILES: CC(=O)c1ccc2n1CCN(C)C21CCN(C(=O)c2ccc(CC(C)C)cc2)CC1.CN1CCn2c(C(=O)C(F)(F)F)ccc2C12CCN(C(=O)c1ccc(OC(C)(C)C)cc1)CC2.CNS(=O)(=O)c1ccc(C(=O)N2CCC3(CC2)c2ccc(C(F)(F)F)n2CCN3C)cc1C
• InChI: InChI=1S/C25H30F3N3O3.C25H33N3O2.C22H27F3N4O3S/c1-23(2,3)34-18-7-5-17(6-8-18)22(33)30-13-11-24(12-14-30)20-10-9-19(21(32)25(26,27)28)31(20)16-15-29(24)4;1-18(2)17-20-5-7-21(8-6-20)24(30)27-13-11-25(12-14-27)23-10-9-22(19(3)29)28(23)16-15-26(25)4;1-15-14-16(4-5-17(15)33(31,32)26-2)20(30)28-10-8-21(9-11-28)18-6-7-19(22(23,24)25)29(18)13-12-27(21)3/h5-10H,11-16H2,1-4H3;5-10,18H,11-17H2,1-4H3;4-7,14,26H,8-13H2,1-3H3
• InChIKey: GCCLMAJIAWJDFA-UHFFFAOYSA-N
• XLogP: 11.25
• TPSA: 174.98 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 14
• Rotatable Bonds: 10
• Heavy Atoms: 97
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1369.63
LogP ≤ 5	11.25
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone?

The IUPAC name of N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone (CID 158211294) is N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone.

What is the SMILES notation for N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone?

The canonical SMILES for N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone is CC(=O)c1ccc2n1CCN(C)C21CCN(C(=O)c2ccc(CC(C)C)cc2)CC1.CN1CCn2c(C(=O)C(F)(F)F)ccc2C12CCN(C(=O)c1ccc(OC(C)(C)C)cc1)CC2.CNS(=O)(=O)c1ccc(C(=O)N2CCC3(CC2)c2ccc(C(F)(F)F)n2CCN3C)cc1C.

What is the InChIKey of N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone?

The InChIKey is GCCLMAJIAWJDFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30F3N3O3.C25H33N3O2.C22H27F3N4O3S/c1-23(2,3)34-18-7-5-17(6-8-18)22(33)30-13-11-24(12-14-30)20-10-9-19(21(32)25(26,27)28)31(20)16-15-29(24)4;1-18(2)17-20-5-7-21(8-6-20)24(30)27-13-11-25(12-14-27)23-10-9-22(19(3)29)28(23)16-15-26(25)4;1-15-14-16(4-5-17(15)33(31,32)26-2)20(30)28-10-8-21(9-11-28)18-6-7-19(22(23,24)25)29(18)13-12-27(21)3/h5-10H,11-16H2,1-4H3;5-10,18H,11-17H2,1-4H3;4-7,14,26H,8-13H2,1-3H3.

What are the key properties of N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone?

N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone has a molecular weight of 1369.63 g/mol, XLogP of 11.25, 10 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for N,2-dimethyl-4-[2-methyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-carbonyl]benzenesulfonamide;1-[2-methyl-1'-[4-(2-methylpropyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-[(2-methylpropan-2-yl)oxy]benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone is sourced from PubChem (CID 158211294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).