(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone

C70H82ClF9N10O7 — CID 157421314

About (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone

(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone (PubChem CID 157421314) has the molecular formula C70H82ClF9N10O7 and a molecular weight of 1381.92 g/mol. Its IUPAC name is (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone.

Molecular Properties

• Compound Name: (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone
• PubChem CID: 157421314
• Molecular Formula: C70H82ClF9N10O7
• Molecular Weight: 1381.92 g/mol
• Exact Mass: 1380.59
• IUPAC Name: (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone
• SMILES: CCc1ccc(C(=O)N2CCC3(CC2)c2ccc(C(=O)C(F)(F)F)n2CCN3C)nc1.CN1CCn2c(Cl)ccc2C12CCN(C(=O)c1ccc(OCC(F)(F)F)cc1)CC2.Cc1cc(C(=O)N2CCC3(CC2)c2ccc(C(F)(F)F)n2CCN3C2CC2)ccc1OCC(C)(C)O
• InChI: InChI=1S/C27H34F3N3O3.C22H25F3N4O2.C21H23ClF3N3O2/c1-18-16-19(4-7-21(18)36-17-25(2,3)35)24(34)31-12-10-26(11-13-31)22-8-9-23(27(28,29)30)32(22)14-15-33(26)20-5-6-20;1-3-15-4-5-16(26-14-15)20(31)28-10-8-21(9-11-28)18-7-6-17(19(30)22(23,24)25)29(18)13-12-27(21)2;1-26-12-13-28-17(6-7-18(28)22)20(26)8-10-27(11-9-20)19(29)15-2-4-16(5-3-15)30-14-21(23,24)25/h4,7-9,16,20,35H,5-6,10-15,17H2,1-3H3;4-7,14H,3,8-13H2,1-2H3;2-7H,8-14H2,1H3
• InChIKey: BPLCJVKKLWPHKU-UHFFFAOYSA-N
• XLogP: 12.00
• TPSA: 154.09 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 14
• Rotatable Bonds: 11
• Heavy Atoms: 97
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1381.92
LogP ≤ 5	12.00
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone?

The IUPAC name of (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone (CID 157421314) is (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone.

What is the SMILES notation for (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone?

The canonical SMILES for (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone is CCc1ccc(C(=O)N2CCC3(CC2)c2ccc(C(=O)C(F)(F)F)n2CCN3C)nc1.CN1CCn2c(Cl)ccc2C12CCN(C(=O)c1ccc(OCC(F)(F)F)cc1)CC2.Cc1cc(C(=O)N2CCC3(CC2)c2ccc(C(F)(F)F)n2CCN3C2CC2)ccc1OCC(C)(C)O.

What is the InChIKey of (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone?

The InChIKey is BPLCJVKKLWPHKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H34F3N3O3.C22H25F3N4O2.C21H23ClF3N3O2/c1-18-16-19(4-7-21(18)36-17-25(2,3)35)24(34)31-12-10-26(11-13-31)22-8-9-23(27(28,29)30)32(22)14-15-33(26)20-5-6-20;1-3-15-4-5-16(26-14-15)20(31)28-10-8-21(9-11-28)18-7-6-17(19(30)22(23,24)25)29(18)13-12-27(21)2;1-26-12-13-28-17(6-7-18(28)22)20(26)8-10-27(11-9-20)19(29)15-2-4-16(5-3-15)30-14-21(23,24)25/h4,7-9,16,20,35H,5-6,10-15,17H2,1-3H3;4-7,14H,3,8-13H2,1-2H3;2-7H,8-14H2,1H3.

What are the key properties of (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone?

(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone has a molecular weight of 1381.92 g/mol, XLogP of 12.00, 11 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[4-(2,2,2-trifluoroethoxy)phenyl]methanone;[2-cyclopropyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-[4-(2-hydroxy-2-methylpropoxy)-3-methylphenyl]methanone;1-[1'-(5-ethylpyridine-2-carbonyl)-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]-2,2,2-trifluoroethanone is sourced from PubChem (CID 157421314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).