About 5-cyclopropyl-3-(1,1-difluoroethyl)-1-propan-2-ylpyrazole;2-cyclopropyl-1-propan-2-yl-4-(trifluoromethyl)imidazole;3-(1,1-difluoroethyl)-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene;5-(1-ethoxyethenyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;ethyl 3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate;6-fluoro-1-methyl-3-propan-2-ylindole;2-(phenylmethoxymethyl)-1-propan-2-yl-4-(trifluoromethyl)imidazole;1-propan-2-ylindole;1,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;7,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene
5-cyclopropyl-3-(1,1-difluoroethyl)-1-propan-2-ylpyrazole;2-cyclopropyl-1-propan-2-yl-4-(trifluoromethyl)imidazole;3-(1,1-difluoroethyl)-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene;5-(1-ethoxyethenyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;ethyl 3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate;6-fluoro-1-methyl-3-propan-2-ylindole;2-(phenylmethoxymethyl)-1-propan-2-yl-4-(trifluoromethyl)imidazole;1-propan-2-ylindole;1,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;7,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene (PubChem CID 162013608) has the molecular formula C154H205F21N22O5
and a molecular weight of 2843.44 g/mol. Its IUPAC name is 5-cyclopropyl-3-(1,1-difluoroethyl)-1-propan-2-ylpyrazole;2-cyclopropyl-1-propan-2-yl-4-(trifluoromethyl)imidazole;3-(1,1-difluoroethyl)-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene;5-(1-ethoxyethenyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;ethyl 3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate;6-fluoro-1-methyl-3-propan-2-ylindole;2-(phenylmethoxymethyl)-1-propan-2-yl-4-(trifluoromethyl)imidazole;1-propan-2-ylindole;1,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;7,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene.
Frequently Asked Questions
What is the IUPAC name of 5-cyclopropyl-3-(1,1-difluoroethyl)-1-propan-2-ylpyrazole;2-cyclopropyl-1-propan-2-yl-4-(trifluoromethyl)imidazole;3-(1,1-difluoroethyl)-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene;5-(1-ethoxyethenyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;ethyl 3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate;6-fluoro-1-methyl-3-propan-2-ylindole;2-(phenylmethoxymethyl)-1-propan-2-yl-4-(trifluoromethyl)imidazole;1-propan-2-ylindole;1,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;7,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene?
The IUPAC name of 5-cyclopropyl-3-(1,1-difluoroethyl)-1-propan-2-ylpyrazole;2-cyclopropyl-1-propan-2-yl-4-(trifluoromethyl)imidazole;3-(1,1-difluoroethyl)-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene;5-(1-ethoxyethenyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;ethyl 3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate;6-fluoro-1-methyl-3-propan-2-ylindole;2-(phenylmethoxymethyl)-1-propan-2-yl-4-(trifluoromethyl)imidazole;1-propan-2-ylindole;1,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;7,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene (CID 162013608) is 5-cyclopropyl-3-(1,1-difluoroethyl)-1-propan-2-ylpyrazole;2-cyclopropyl-1-propan-2-yl-4-(trifluoromethyl)imidazole;3-(1,1-difluoroethyl)-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene;5-(1-ethoxyethenyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;ethyl 3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate;6-fluoro-1-methyl-3-propan-2-ylindole;2-(phenylmethoxymethyl)-1-propan-2-yl-4-(trifluoromethyl)imidazole;1-propan-2-ylindole;1,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;7,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene.
What is the SMILES notation for 5-cyclopropyl-3-(1,1-difluoroethyl)-1-propan-2-ylpyrazole;2-cyclopropyl-1-propan-2-yl-4-(trifluoromethyl)imidazole;3-(1,1-difluoroethyl)-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene;5-(1-ethoxyethenyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;ethyl 3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate;6-fluoro-1-methyl-3-propan-2-ylindole;2-(phenylmethoxymethyl)-1-propan-2-yl-4-(trifluoromethyl)imidazole;1-propan-2-ylindole;1,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;7,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene?
The canonical SMILES for 5-cyclopropyl-3-(1,1-difluoroethyl)-1-propan-2-ylpyrazole;2-cyclopropyl-1-propan-2-yl-4-(trifluoromethyl)imidazole;3-(1,1-difluoroethyl)-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene;5-(1-ethoxyethenyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;ethyl 3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate;6-fluoro-1-methyl-3-propan-2-ylindole;2-(phenylmethoxymethyl)-1-propan-2-yl-4-(trifluoromethyl)imidazole;1-propan-2-ylindole;1,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;7,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene is C=C(OCC)c1nn(C(C)C)c2c1C1CCC2C1.CC(C)c1cn(C)c2cc(F)ccc12.CC(C)n1cc(C(F)(F)F)nc1C1CC1.CC(C)n1cc(C(F)(F)F)nc1COCc1ccccc1.CC(C)n1ccc2ccccc21.CC(C)n1nc(C(C)(F)F)c2c1CCCC2=O.CC(C)n1nc(C(C)(F)F)cc1C1CC1.CC(C)n1nc(C(F)(F)F)c2c1C1(C)CCC2C1(C)C.CC(C)n1nc(C(F)(F)F)c2c1C1CCC2(C)C1(C)C.CC(C)n1nc(C(F)F)c2c1C1CC(C2)C1.CC(C)n1nc(C(F)F)c2c1C1CCC2C1.CCOC(=O)c1nn(C(C)C)c2c1CC1CC2C1.
What is the InChIKey of 5-cyclopropyl-3-(1,1-difluoroethyl)-1-propan-2-ylpyrazole;2-cyclopropyl-1-propan-2-yl-4-(trifluoromethyl)imidazole;3-(1,1-difluoroethyl)-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene;5-(1-ethoxyethenyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;ethyl 3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate;6-fluoro-1-methyl-3-propan-2-ylindole;2-(phenylmethoxymethyl)-1-propan-2-yl-4-(trifluoromethyl)imidazole;1-propan-2-ylindole;1,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;7,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene?
The InChIKey is YTUPXMIZMAXTMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17F3N2O.2C15H21F3N2.C15H22N2O.C14H20N2O2.C12H16F2N2O.2C12H16F2N2.C12H14FN.C11H16F2N2.C11H13N.C10H13F3N2/c1-11(2)20-8-13(15(16,17)18)19-14(20)10-21-9-12-6-4-3-5-7-12;1-8(2)20-11-9-6-7-14(5,13(9,3)4)10(11)12(19-20)15(16,17)18;1-8(2)20-12-10(11(19-20)15(16,17)18)9-6-7-14(12,5)13(9,3)4;1-5-18-10(4)14-13-11-6-7-12(8-11)15(13)17(16-14)9(2)3;1-4-18-14(17)12-11-7-9-5-10(6-9)13(11)16(15-12)8(2)3;1-7(2)16-8-5-4-6-9(17)10(8)11(15-16)12(3,13)14;1-6(2)16-11-8-3-7(4-8)5-9(11)10(15-16)12(13)14;1-6(2)16-11-8-4-3-7(5-8)9(11)10(15-16)12(13)14;1-8(2)11-7-14(3)12-6-9(13)4-5-10(11)12;1-7(2)15-9(8-4-5-8)6-10(14-15)11(3,12)13;1-9(2)12-8-7-10-5-3-4-6-11(10)12;1-6(2)15-5-8(10(11,12)13)14-9(15)7-3-4-7/h3-8,11H,9-10H2,1-2H3;2*8-9H,6-7H2,1-5H3;9,11-12H,4-8H2,1-3H3;8-10H,4-7H2,1-3H3;7H,4-6H2,1-3H3;2*6-8,12H,3-5H2,1-2H3;4-8H,1-3H3;6-8H,4-5H2,1-3H3;3-9H,1-2H3;5-7H,3-4H2,1-2H3.
What are the key properties of 5-cyclopropyl-3-(1,1-difluoroethyl)-1-propan-2-ylpyrazole;2-cyclopropyl-1-propan-2-yl-4-(trifluoromethyl)imidazole;3-(1,1-difluoroethyl)-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene;5-(1-ethoxyethenyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;ethyl 3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate;6-fluoro-1-methyl-3-propan-2-ylindole;2-(phenylmethoxymethyl)-1-propan-2-yl-4-(trifluoromethyl)imidazole;1-propan-2-ylindole;1,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;7,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene?
5-cyclopropyl-3-(1,1-difluoroethyl)-1-propan-2-ylpyrazole;2-cyclopropyl-1-propan-2-yl-4-(trifluoromethyl)imidazole;3-(1,1-difluoroethyl)-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene;5-(1-ethoxyethenyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;ethyl 3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate;6-fluoro-1-methyl-3-propan-2-ylindole;2-(phenylmethoxymethyl)-1-propan-2-yl-4-(trifluoromethyl)imidazole;1-propan-2-ylindole;1,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;7,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene has a molecular weight of 2843.44 g/mol, XLogP of 43.83, 27 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-3-(1,1-difluoroethyl)-1-propan-2-ylpyrazole;2-cyclopropyl-1-propan-2-yl-4-(trifluoromethyl)imidazole;3-(1,1-difluoroethyl)-1-propan-2-yl-6,7-dihydro-5H-indazol-4-one;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;5-(difluoromethyl)-3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene;5-(1-ethoxyethenyl)-3-propan-2-yl-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;ethyl 3-propan-2-yl-3,4-diazatricyclo[6.1.1.02,6]deca-2(6),4-diene-5-carboxylate;6-fluoro-1-methyl-3-propan-2-ylindole;2-(phenylmethoxymethyl)-1-propan-2-yl-4-(trifluoromethyl)imidazole;1-propan-2-ylindole;1,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene;7,10,10-trimethyl-3-propan-2-yl-5-(trifluoromethyl)-3,4-diazatricyclo[5.2.1.02,6]deca-2(6),4-diene is sourced from PubChem (CID 162013608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).