[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone

C182H215Cl3F21N41O19 — CID 158989409

About [1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone

[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone (PubChem CID 158989409) has the molecular formula C182H215Cl3F21N41O19 and a molecular weight of 3786.31 g/mol. Its IUPAC name is [1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone.

Molecular Properties

• Compound Name: [1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone
• PubChem CID: 158989409
• Molecular Formula: C182H215Cl3F21N41O19
• Molecular Weight: 3786.31 g/mol
• Exact Mass: 3782.58
• IUPAC Name: [1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone
• SMILES: O=C(c1cnn(C(=O)N2CC3CN(Cc4cc(Cl)cc(C(F)(F)F)c4)CC3C2)c1)N1CCCC1.O=C(c1cnn(C(=O)N2CC3CN(Cc4cc(Cl)cc(C(F)(F)F)c4)CC3C2)c1)N1CCN(C2CC2)CC1.O=C(c1cnn(C(=O)N2CC3CN(Cc4cc(Cl)cc(C(F)(F)F)c4)CC3C2)c1)N1CCOCC1.O=C(c1cnn(C(=O)N2CC3CN(Cc4ccc(N5CCOCC5)cc4C(F)(F)F)CC3C2)c1)N1CCCC1.O=C(c1cnn(C(=O)N2CC3CN(Cc4ccc(N5CCOCC5)cc4C(F)(F)F)CC3C2)c1)N1CCN(C2CC2)CC1.O=C(c1cnn(C(=O)N2CC3CN(Cc4ccc(N5CCOCC5)cc4C(F)(F)F)CC3C2)c1)N1CCOCC1.O=C(c1cnn(C(=O)N2CC3CN(Cc4cccc(C(F)(F)F)c4)CC3C2)c1)N1CCN(C2CC2)CC1
• InChI: InChI=1S/C30H38F3N7O3.C27H33F3N6O4.C27H33F3N6O3.C26H30ClF3N6O2.C26H31F3N6O2.C23H25ClF3N5O3.C23H25ClF3N5O2/c31-30(32,33)27-13-26(37-9-11-43-12-10-37)2-1-21(27)15-35-16-23-18-39(19-24(23)17-35)29(42)40-20-22(14-34-40)28(41)38-7-5-36(6-8-38)25-3-4-25;28-27(29,30)24-11-23(33-3-7-39-8-4-33)2-1-19(24)13-32-14-21-16-35(17-22(21)15-32)26(38)36-18-20(12-31-36)25(37)34-5-9-40-10-6-34;28-27(29,30)24-11-23(33-7-9-39-10-8-33)4-3-19(24)13-32-14-21-16-35(17-22(21)15-32)26(38)36-18-20(12-31-36)25(37)34-5-1-2-6-34;27-22-8-17(7-21(9-22)26(28,29)30)11-32-12-19-14-35(15-20(19)13-32)25(38)36-16-18(10-31-36)24(37)34-5-3-33(4-6-34)23-1-2-23;27-26(28,29)22-3-1-2-18(10-22)12-31-13-20-15-34(16-21(20)14-31)25(37)35-17-19(11-30-35)24(36)33-8-6-32(7-9-33)23-4-5-23;24-20-6-15(5-19(7-20)23(25,26)27)9-29-10-17-12-31(13-18(17)11-29)22(34)32-14-16(8-28-32)21(33)30-1-3-35-4-2-30;24-20-6-15(5-19(7-20)23(25,26)27)9-29-10-17-12-31(13-18(17)11-29)22(34)32-14-16(8-28-32)21(33)30-3-1-2-4-30/h1-2,13-14,20,23-25H,3-12,15-19H2;1-2,11-12,18,21-22H,3-10,13-17H2;3-4,11-12,18,21-22H,1-2,5-10,13-17H2;7-10,16,19-20,23H,1-6,11-15H2;1-3,10-11,17,20-21,23H,4-9,12-16H2;5-8,14,17-18H,1-4,9-13H2;5-8,14,17-18H,1-4,9-13H2
• InChIKey: JPZAPSJTIPWQJQ-UHFFFAOYSA-N
• XLogP: 21.18
• TPSA: 497.35 Ų
• H-Bond Acceptors: 46
• Rotatable Bonds: 27
• Heavy Atoms: 266
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3786.31
LogP ≤ 5	21.18
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	46

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone?

The IUPAC name of [1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone (CID 158989409) is [1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone.

What is the SMILES notation for [1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone?

The canonical SMILES for [1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone is O=C(c1cnn(C(=O)N2CC3CN(Cc4cc(Cl)cc(C(F)(F)F)c4)CC3C2)c1)N1CCCC1.O=C(c1cnn(C(=O)N2CC3CN(Cc4cc(Cl)cc(C(F)(F)F)c4)CC3C2)c1)N1CCN(C2CC2)CC1.O=C(c1cnn(C(=O)N2CC3CN(Cc4cc(Cl)cc(C(F)(F)F)c4)CC3C2)c1)N1CCOCC1.O=C(c1cnn(C(=O)N2CC3CN(Cc4ccc(N5CCOCC5)cc4C(F)(F)F)CC3C2)c1)N1CCCC1.O=C(c1cnn(C(=O)N2CC3CN(Cc4ccc(N5CCOCC5)cc4C(F)(F)F)CC3C2)c1)N1CCN(C2CC2)CC1.O=C(c1cnn(C(=O)N2CC3CN(Cc4ccc(N5CCOCC5)cc4C(F)(F)F)CC3C2)c1)N1CCOCC1.O=C(c1cnn(C(=O)N2CC3CN(Cc4cccc(C(F)(F)F)c4)CC3C2)c1)N1CCN(C2CC2)CC1.

What is the InChIKey of [1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone?

The InChIKey is JPZAPSJTIPWQJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H38F3N7O3.C27H33F3N6O4.C27H33F3N6O3.C26H30ClF3N6O2.C26H31F3N6O2.C23H25ClF3N5O3.C23H25ClF3N5O2/c31-30(32,33)27-13-26(37-9-11-43-12-10-37)2-1-21(27)15-35-16-23-18-39(19-24(23)17-35)29(42)40-20-22(14-34-40)28(41)38-7-5-36(6-8-38)25-3-4-25;28-27(29,30)24-11-23(33-3-7-39-8-4-33)2-1-19(24)13-32-14-21-16-35(17-22(21)15-32)26(38)36-18-20(12-31-36)25(37)34-5-9-40-10-6-34;28-27(29,30)24-11-23(33-7-9-39-10-8-33)4-3-19(24)13-32-14-21-16-35(17-22(21)15-32)26(38)36-18-20(12-31-36)25(37)34-5-1-2-6-34;27-22-8-17(7-21(9-22)26(28,29)30)11-32-12-19-14-35(15-20(19)13-32)25(38)36-16-18(10-31-36)24(37)34-5-3-33(4-6-34)23-1-2-23;27-26(28,29)22-3-1-2-18(10-22)12-31-13-20-15-34(16-21(20)14-31)25(37)35-17-19(11-30-35)24(36)33-8-6-32(7-9-33)23-4-5-23;24-20-6-15(5-19(7-20)23(25,26)27)9-29-10-17-12-31(13-18(17)11-29)22(34)32-14-16(8-28-32)21(33)30-1-3-35-4-2-30;24-20-6-15(5-19(7-20)23(25,26)27)9-29-10-17-12-31(13-18(17)11-29)22(34)32-14-16(8-28-32)21(33)30-3-1-2-4-30/h1-2,13-14,20,23-25H,3-12,15-19H2;1-2,11-12,18,21-22H,3-10,13-17H2;3-4,11-12,18,21-22H,1-2,5-10,13-17H2;7-10,16,19-20,23H,1-6,11-15H2;1-3,10-11,17,20-21,23H,4-9,12-16H2;5-8,14,17-18H,1-4,9-13H2;5-8,14,17-18H,1-4,9-13H2.

What are the key properties of [1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone?

[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone has a molecular weight of 3786.31 g/mol, XLogP of 21.18, 27 rotatable bonds, 0 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for [1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-(4-cyclopropylpiperazin-1-yl)methanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;[1-[2-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;(4-cyclopropylpiperazin-1-yl)-[1-[2-[[3-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;morpholin-4-yl-[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]methanone;[1-[2-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 158989409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).