2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole

C152H197ClF27N27O6 — CID 158101022

IUPAC2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole
SMILESC#Cc1cn(C(C)C)nc1C(F)(F)F.CC(C)C1=CCc2cc(C3CC3)c(=O)[nH]c21.CC(C)C1=CCc2ccc(=O)[nH]c21.CC(C)c1ccnc(Cl)c1.CC(C)n1cc(C2CC2)c(C#N)n1.CC(C)n1cc(CCC2CC2)c(C(F)(F)F)n1.CC(C)n1cnc2c(=O)[nH]ccc21.CC(C)n1nc(C(F)(F)F)c2c1C(C)(F)CCC2=O.CC(C)n1nc(C(F)(F)F)c2c1CCC=C2.CC(C)n1nc(C(F)F)c2c1C(C)(F)CCC2O.CC(C)n1nc(C(F)F)c2c1C1CC1CC2.CC1CCc2c(C(F)(F)F)nn(C(C)C)c2C1.CCCc1cn(C(C)C)nc1C(F)(F)F.CCOCc1cn(C(C)C)nc1C(F)(F)F
InChIInChI=1S/C14H17NO.C12H14F4N2O.C12H17F3N2O.2C12H17F3N2.C12H16F2N2.C11H13F3N2.C11H13NO.C10H15F3N2O.C10H15F3N2.C10H13N3.C9H9F3N2.C9H11N3O.C8H10ClN/c1-8(2)11-6-5-10-7-12(9-3-4-9)14(16)15-13(10)11;1-6(2)18-10-8(9(17-18)12(14,15)16)7(19)4-5-11(10,3)13;1-6(2)17-10-8(9(16-17)11(13)14)7(18)4-5-12(10,3)15;1-7(2)17-10-6-8(3)4-5-9(10)11(16-17)12(13,14)15;1-8(2)17-7-10(6-5-9-3-4-9)11(16-17)12(13,14)15;1-6(2)16-11-8(10(15-16)12(13)14)4-3-7-5-9(7)11;1-7(2)16-9-6-4-3-5-8(9)10(15-16)11(12,13)14;1-7(2)9-5-3-8-4-6-10(13)12-11(8)9;1-4-16-6-8-5-15(7(2)3)14-9(8)10(11,12)13;1-4-5-8-6-15(7(2)3)14-9(8)10(11,12)13;1-7(2)13-6-9(8-3-4-8)10(5-11)12-13;1-4-7-5-14(6(2)3)13-8(7)9(10,11)12;1-6(2)12-5-11-8-7(12)3-4-10-9(8)13;1-6(2)7-3-4-10-8(9)5-7/h6-9H,3-5H2,1-2H3,(H,15,16);6H,4-5H2,1-3H3;6-7,11,18H,4-5H2,1-3H3;7-8H,4-6H2,1-3H3;7-9H,3-6H2,1-2H3;6-7,9,12H,3-5H2,1-2H3;3,5,7H,4,6H2,1-2H3;4-7H,3H2,1-2H3,(H,12,13);5,7H,4,6H2,1-3H3;6-7H,4-5H2,1-3H3;6-8H,3-4H2,1-2H3;1,5-6H,2-3H3;3-6H,1-2H3,(H,10,13);3-6H,1-2H3
InChIKeyFPGGUHJCHAQBDW-UHFFFAOYSA-N
MW3046.83 g/mol
LogP41.50
Rot. Bonds26

About 2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole

2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole (PubChem CID 158101022) has the molecular formula C152H197ClF27N27O6 and a molecular weight of 3046.83 g/mol. Its IUPAC name is 2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole.

Molecular Properties

Compound Name2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole
PubChem CID158101022
Molecular FormulaC152H197ClF27N27O6
Molecular Weight3046.83 g/mol
Exact Mass3044.52
IUPAC Name2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole
SMILESC#Cc1cn(C(C)C)nc1C(F)(F)F.CC(C)C1=CCc2cc(C3CC3)c(=O)[nH]c21.CC(C)C1=CCc2ccc(=O)[nH]c21.CC(C)c1ccnc(Cl)c1.CC(C)n1cc(C2CC2)c(C#N)n1.CC(C)n1cc(CCC2CC2)c(C(F)(F)F)n1.CC(C)n1cnc2c(=O)[nH]ccc21.CC(C)n1nc(C(F)(F)F)c2c1C(C)(F)CCC2=O.CC(C)n1nc(C(F)(F)F)c2c1CCC=C2.CC(C)n1nc(C(F)F)c2c1C(C)(F)CCC2O.CC(C)n1nc(C(F)F)c2c1C1CC1CC2.CC1CCc2c(C(F)(F)F)nn(C(C)C)c2C1.CCCc1cn(C(C)C)nc1C(F)(F)F.CCOCc1cn(C(C)C)nc1C(F)(F)F
InChIInChI=1S/C14H17NO.C12H14F4N2O.C12H17F3N2O.2C12H17F3N2.C12H16F2N2.C11H13F3N2.C11H13NO.C10H15F3N2O.C10H15F3N2.C10H13N3.C9H9F3N2.C9H11N3O.C8H10ClN/c1-8(2)11-6-5-10-7-12(9-3-4-9)14(16)15-13(10)11;1-6(2)18-10-8(9(17-18)12(14,15)16)7(19)4-5-11(10,3)13;1-6(2)17-10-8(9(16-17)11(13)14)7(18)4-5-12(10,3)15;1-7(2)17-10-6-8(3)4-5-9(10)11(16-17)12(13,14)15;1-8(2)17-7-10(6-5-9-3-4-9)11(16-17)12(13,14)15;1-6(2)16-11-8(10(15-16)12(13)14)4-3-7-5-9(7)11;1-7(2)16-9-6-4-3-5-8(9)10(15-16)11(12,13)14;1-7(2)9-5-3-8-4-6-10(13)12-11(8)9;1-4-16-6-8-5-15(7(2)3)14-9(8)10(11,12)13;1-4-5-8-6-15(7(2)3)14-9(8)10(11,12)13;1-7(2)13-6-9(8-3-4-8)10(5-11)12-13;1-4-7-5-14(6(2)3)13-8(7)9(10,11)12;1-6(2)12-5-11-8-7(12)3-4-10-9(8)13;1-6(2)7-3-4-10-8(9)5-7/h6-9H,3-5H2,1-2H3,(H,15,16);6H,4-5H2,1-3H3;6-7,11,18H,4-5H2,1-3H3;7-8H,4-6H2,1-3H3;7-9H,3-6H2,1-2H3;6-7,9,12H,3-5H2,1-2H3;3,5,7H,4,6H2,1-2H3;4-7H,3H2,1-2H3,(H,12,13);5,7H,4,6H2,1-3H3;6-7H,4-5H2,1-3H3;6-8H,3-4H2,1-2H3;1,5-6H,2-3H3;3-6H,1-2H3,(H,10,13);3-6H,1-2H3
InChIKeyFPGGUHJCHAQBDW-UHFFFAOYSA-N
XLogP41.50
TPSA377.81 Ų
H-Bond Donors4
H-Bond Acceptors30
Rotatable Bonds26
Heavy Atoms213
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003046.83
LogP ≤ 541.50
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole?
The IUPAC name of 2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole (CID 158101022) is 2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole.
What is the SMILES notation for 2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole?
The canonical SMILES for 2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole is C#Cc1cn(C(C)C)nc1C(F)(F)F.CC(C)C1=CCc2cc(C3CC3)c(=O)[nH]c21.CC(C)C1=CCc2ccc(=O)[nH]c21.CC(C)c1ccnc(Cl)c1.CC(C)n1cc(C2CC2)c(C#N)n1.CC(C)n1cc(CCC2CC2)c(C(F)(F)F)n1.CC(C)n1cnc2c(=O)[nH]ccc21.CC(C)n1nc(C(F)(F)F)c2c1C(C)(F)CCC2=O.CC(C)n1nc(C(F)(F)F)c2c1CCC=C2.CC(C)n1nc(C(F)F)c2c1C(C)(F)CCC2O.CC(C)n1nc(C(F)F)c2c1C1CC1CC2.CC1CCc2c(C(F)(F)F)nn(C(C)C)c2C1.CCCc1cn(C(C)C)nc1C(F)(F)F.CCOCc1cn(C(C)C)nc1C(F)(F)F.
What is the InChIKey of 2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole?
The InChIKey is FPGGUHJCHAQBDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO.C12H14F4N2O.C12H17F3N2O.2C12H17F3N2.C12H16F2N2.C11H13F3N2.C11H13NO.C10H15F3N2O.C10H15F3N2.C10H13N3.C9H9F3N2.C9H11N3O.C8H10ClN/c1-8(2)11-6-5-10-7-12(9-3-4-9)14(16)15-13(10)11;1-6(2)18-10-8(9(17-18)12(14,15)16)7(19)4-5-11(10,3)13;1-6(2)17-10-8(9(16-17)11(13)14)7(18)4-5-12(10,3)15;1-7(2)17-10-6-8(3)4-5-9(10)11(16-17)12(13,14)15;1-8(2)17-7-10(6-5-9-3-4-9)11(16-17)12(13,14)15;1-6(2)16-11-8(10(15-16)12(13)14)4-3-7-5-9(7)11;1-7(2)16-9-6-4-3-5-8(9)10(15-16)11(12,13)14;1-7(2)9-5-3-8-4-6-10(13)12-11(8)9;1-4-16-6-8-5-15(7(2)3)14-9(8)10(11,12)13;1-4-5-8-6-15(7(2)3)14-9(8)10(11,12)13;1-7(2)13-6-9(8-3-4-8)10(5-11)12-13;1-4-7-5-14(6(2)3)13-8(7)9(10,11)12;1-6(2)12-5-11-8-7(12)3-4-10-9(8)13;1-6(2)7-3-4-10-8(9)5-7/h6-9H,3-5H2,1-2H3,(H,15,16);6H,4-5H2,1-3H3;6-7,11,18H,4-5H2,1-3H3;7-8H,4-6H2,1-3H3;7-9H,3-6H2,1-2H3;6-7,9,12H,3-5H2,1-2H3;3,5,7H,4,6H2,1-2H3;4-7H,3H2,1-2H3,(H,12,13);5,7H,4,6H2,1-3H3;6-7H,4-5H2,1-3H3;6-8H,3-4H2,1-2H3;1,5-6H,2-3H3;3-6H,1-2H3,(H,10,13);3-6H,1-2H3.
What are the key properties of 2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole?
2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole has a molecular weight of 3046.83 g/mol, XLogP of 41.50, 26 rotatable bonds, 4 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-propan-2-ylpyridine;4-(2-cyclopropylethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;3-cyclopropyl-7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;4-cyclopropyl-1-propan-2-ylpyrazole-3-carbonitrile;3-(difluoromethyl)-7-fluoro-7-methyl-1-propan-2-yl-5,6-dihydro-4H-indazol-4-ol;3-(difluoromethyl)-1-propan-2-yl-5,5a,6,6a-tetrahydro-4H-cyclopropa[g]indazole;4-(ethoxymethyl)-1-propan-2-yl-3-(trifluoromethyl)pyrazole;4-ethynyl-1-propan-2-yl-3-(trifluoromethyl)pyrazole;7-fluoro-7-methyl-1-propan-2-yl-3-(trifluoromethyl)-5,6-dihydroindazol-4-one;6-methyl-1-propan-2-yl-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazole;7-propan-2-yl-1,5-dihydrocyclopenta[b]pyridin-2-one;1-propan-2-yl-5H-imidazo[4,5-c]pyridin-4-one;1-propan-2-yl-4-propyl-3-(trifluoromethyl)pyrazole;1-propan-2-yl-3-(trifluoromethyl)-6,7-dihydroindazole is sourced from PubChem (CID 158101022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).