(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone

C76H99ClF3N9O10 — CID 158882762

About (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone

(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone (PubChem CID 158882762) has the molecular formula C76H99ClF3N9O10 and a molecular weight of 1391.13 g/mol. Its IUPAC name is (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone.

Molecular Properties

• Compound Name: (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone
• PubChem CID: 158882762
• Molecular Formula: C76H99ClF3N9O10
• Molecular Weight: 1391.13 g/mol
• Exact Mass: 1389.72
• IUPAC Name: (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone
• SMILES: CCCOc1cc(C(=O)N2CCC3(CC2)c2ccc(Cl)n2CCN3C)ccc1OC.COc1cc(C(=O)N2CCC3(CC2)c2ccc(C(C)=O)n2CCN3C)ccc1OCC(C)C.Cc1cc(C(=O)N2CCC3(CC2)c2cc(C(=O)C(F)(F)F)cn2C(C)(C)CN3C)ccc1OC(C)C
• InChI: InChI=1S/C27H34F3N3O3.C26H35N3O4.C23H30ClN3O3/c1-17(2)36-21-8-7-19(13-18(21)3)24(35)32-11-9-26(10-12-32)22-14-20(23(34)27(28,29)30)15-33(22)25(4,5)16-31(26)6;1-18(2)17-33-22-8-6-20(16-23(22)32-5)25(31)28-12-10-26(11-13-28)24-9-7-21(19(3)30)29(24)15-14-27(26)4;1-4-15-30-19-16-17(5-6-18(19)29-3)22(28)26-11-9-23(10-12-26)20-7-8-21(24)27(20)14-13-25(23)2/h7-8,13-15,17H,9-12,16H2,1-6H3;6-9,16,18H,10-15,17H2,1-5H3;5-8,16H,4,9-15H2,1-3H3
• InChIKey: JDFSPYNLJRAWHC-UHFFFAOYSA-N
• XLogP: 12.97
• TPSA: 165.73 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 15
• Heavy Atoms: 99
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1391.13
LogP ≤ 5	12.97
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

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-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone?

The IUPAC name of (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone (CID 158882762) is (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone.

What is the SMILES notation for (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone?

The canonical SMILES for (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone is CCCOc1cc(C(=O)N2CCC3(CC2)c2ccc(Cl)n2CCN3C)ccc1OC.COc1cc(C(=O)N2CCC3(CC2)c2ccc(C(C)=O)n2CCN3C)ccc1OCC(C)C.Cc1cc(C(=O)N2CCC3(CC2)c2cc(C(=O)C(F)(F)F)cn2C(C)(C)CN3C)ccc1OC(C)C.

What is the InChIKey of (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone?

The InChIKey is JDFSPYNLJRAWHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H34F3N3O3.C26H35N3O4.C23H30ClN3O3/c1-17(2)36-21-8-7-19(13-18(21)3)24(35)32-11-9-26(10-12-32)22-14-20(23(34)27(28,29)30)15-33(22)25(4,5)16-31(26)6;1-18(2)17-33-22-8-6-20(16-23(22)32-5)25(31)28-12-10-26(11-13-28)24-9-7-21(19(3)30)29(24)15-14-27(26)4;1-4-15-30-19-16-17(5-6-18(19)29-3)22(28)26-11-9-23(10-12-26)20-7-8-21(24)27(20)14-13-25(23)2/h7-8,13-15,17H,9-12,16H2,1-6H3;6-9,16,18H,10-15,17H2,1-5H3;5-8,16H,4,9-15H2,1-3H3.

What are the key properties of (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone?

(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-(4-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone has a molecular weight of 1391.13 g/mol, XLogP of 12.97, 15 rotatable bonds, 0 hydrogen bond donors, and 16 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-methoxy-3-propoxyphenyl)methanone;1-[1'-[3-methoxy-4-(2-methylpropoxy)benzoyl]-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone;2,2,2-trifluoro-1-[2,4,4-trimethyl-1'-(3-methyl-4-propan-2-yloxybenzoyl)spiro[3H-pyrrolo[1,2-a]pyrazine-1,4'-piperidine]-7-yl]ethanone is sourced from PubChem (CID 158882762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).