5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole)

C132H174Cl2F28N26O3 — CID 157207731

About 5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole)

5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole) (PubChem CID 157207731) has the molecular formula C132H174Cl2F28N26O3 and a molecular weight of 2775.87 g/mol. Its IUPAC name is 5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole).

Molecular Properties

• Compound Name: 5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole)
• PubChem CID: 157207731
• Molecular Formula: C132H174Cl2F28N26O3
• Molecular Weight: 2775.87 g/mol
• Exact Mass: 2773.32
• IUPAC Name: 5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole)
• SMILES: C=C(N)c1cn(C(C)C)nc1C(F)(F)F.CC(C)N1C(=O)Cc2cc(Cl)c(Cl)cc21.CC(C)n1cc(CN(C)C)c(C(F)(F)F)n1.CC(C)n1cc(CN2CCCCC2)c(C(F)(F)F)n1.CC(C)n1ccc2ccc(=O)[nH]c21.CC(C)n1nc(C(F)(F)F)c2c1C(F)(F)CCC2.CC(C)n1nc(C(F)(F)F)c2c1CCCC2.CC(C)n1nc(C(F)(F)F)c2c1CCCC2.CC(C)n1nc(C(F)F)c2c1C1CC1CC2.CC(C)n1nc(C(F)F)c2c1C1CC1CC2(F)F.CC(C)n1nc(C(F)F)c2c1CCCC2.Cc1nn(C(C)C)c2cc(O)ccc12
• InChI: InChI=1S/C13H20F3N3.C12H14F4N2.C12H16F2N2.C11H11Cl2NO.C11H13F5N2.2C11H15F3N2.C11H16F2N2.C11H14N2O.C10H16F3N3.C10H12N2O.C9H12F3N3/c1-10(2)19-9-11(12(17-19)13(14,15)16)8-18-6-4-3-5-7-18;1-5(2)18-10-7-3-6(7)4-12(15,16)8(10)9(17-18)11(13)14;1-6(2)16-11-8(10(15-16)12(13)14)4-3-7-5-9(7)11;1-6(2)14-10-5-9(13)8(12)3-7(10)4-11(14)15;1-6(2)18-9-7(4-3-5-10(9,12)13)8(17-18)11(14,15)16;2*1-7(2)16-9-6-4-3-5-8(9)10(15-16)11(12,13)14;1-7(2)15-9-6-4-3-5-8(9)10(14-15)11(12)13;1-7(2)13-11-6-9(14)4-5-10(11)8(3)12-13;1-7(2)16-6-8(5-15(3)4)9(14-16)10(11,12)13;1-7(2)12-6-5-8-3-4-9(13)11-10(8)12;1-5(2)15-4-7(6(3)13)8(14-15)9(10,11)12/h9-10H,3-8H2,1-2H3;5-7,11H,3-4H2,1-2H3;6-7,9,12H,3-5H2,1-2H3;3,5-6H,4H2,1-2H3;6H,3-5H2,1-2H3;2*7H,3-6H2,1-2H3;7,11H,3-6H2,1-2H3;4-7,14H,1-3H3;6-7H,5H2,1-4H3;3-7H,1-2H3,(H,11,13);4-5H,3,13H2,1-2H3
• InChIKey: ARNSEPAUVYXDJS-UHFFFAOYSA-N
• XLogP: 37.62
• TPSA: 289.03 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 27
• Rotatable Bonds: 20
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2775.87
LogP ≤ 5	37.62
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole)?

The IUPAC name of 5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole) (CID 157207731) is 5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole).

What is the SMILES notation for 5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole)?

The canonical SMILES for 5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole) is C=C(N)c1cn(C(C)C)nc1C(F)(F)F.CC(C)N1C(=O)Cc2cc(Cl)c(Cl)cc21.CC(C)n1cc(CN(C)C)c(C(F)(F)F)n1.CC(C)n1cc(CN2CCCCC2)c(C(F)(F)F)n1.CC(C)n1ccc2ccc(=O)[nH]c21.CC(C)n1nc(C(F)(F)F)c2c1C(F)(F)CCC2.CC(C)n1nc(C(F)(F)F)c2c1CCCC2.CC(C)n1nc(C(F)(F)F)c2c1CCCC2.CC(C)n1nc(C(F)F)c2c1C1CC1CC2.CC(C)n1nc(C(F)F)c2c1C1CC1CC2(F)F.CC(C)n1nc(C(F)F)c2c1CCCC2.Cc1nn(C(C)C)c2cc(O)ccc12.

What is the InChIKey of 5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole)?

The InChIKey is ARNSEPAUVYXDJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20F3N3.C12H14F4N2.C12H16F2N2.C11H11Cl2NO.C11H13F5N2.2C11H15F3N2.C11H16F2N2.C11H14N2O.C10H16F3N3.C10H12N2O.C9H12F3N3/c1-10(2)19-9-11(12(17-19)13(14,15)16)8-18-6-4-3-5-7-18;1-5(2)18-10-7-3-6(7)4-12(15,16)8(10)9(17-18)11(13)14;1-6(2)16-11-8(10(15-16)12(13)14)4-3-7-5-9(7)11;1-6(2)14-10-5-9(13)8(12)3-7(10)4-11(14)15;1-6(2)18-9-7(4-3-5-10(9,12)13)8(17-18)11(14,15)16;2*1-7(2)16-9-6-4-3-5-8(9)10(15-16)11(12,13)14;1-7(2)15-9-6-4-3-5-8(9)10(14-15)11(12)13;1-7(2)13-11-6-9(14)4-5-10(11)8(3)12-13;1-7(2)16-6-8(5-15(3)4)9(14-16)10(11,12)13;1-7(2)12-6-5-8-3-4-9(13)11-10(8)12;1-5(2)15-4-7(6(3)13)8(14-15)9(10,11)12/h9-10H,3-8H2,1-2H3;5-7,11H,3-4H2,1-2H3;6-7,9,12H,3-5H2,1-2H3;3,5-6H,4H2,1-2H3;6H,3-5H2,1-2H3;2*7H,3-6H2,1-2H3;7,11H,3-6H2,1-2H3;4-7,14H,1-3H3;6-7H,5H2,1-4H3;3-7H,1-2H3,(H,11,13);4-5H,3,13H2,1-2H3.

What are the key properties of 5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole)?

5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole) has a molecular weight of 2775.87 g/mol, XLogP of 37.62, 20 rotatable bonds, 3 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 5,6-dichloro-1-propan-2-yl-3H-indol-2-one;3-(difluoromethyl)-4,4-difluoro-1-propan-2-yl-5,5a,6,6a-tetrahydrocyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;3-(difluoromethyl)-1-propan-2-yl-4,5,6,7-tetrahydroindazole;7,7-difluoro-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydro-4H-indazole;N,N-dimethyl-1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methanamine;3-methyl-1-propan-2-ylindazol-6-ol;1-propan-2-yl-7H-pyrrolo[2,3-b]pyridin-6-one;1-[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]ethenamine;1-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]piperidine;bis(1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole) is sourced from PubChem (CID 157207731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).