2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole

C148H241F26N33 — CID 167562682

IUPAC2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole
SMILESCC(C)(C)c1nc(C(C)(F)F)cn1C1CC1.CC(C)(C)c1nc(C(C)(F)F)cn1C1CCC1.CC(C)(C)c1nc(C(C)(F)F)cn1CCF.CC(C)n1cc(C(C)(F)F)nc1C(C)(C)C.CC(F)c1nc(C(C)(C)C)n(C)n1.CC(F)c1nc(C(C)(C)C)nn1C.CCn1cc(C(C)(F)F)nc1C(C)(C)C.CN1CC(n2cc(C(C)(F)F)nc2C(C)(C)C)C1.Cc1cc(C(C)(F)F)nn1C(C)(C)C.Cc1cc(C(C)F)nn1C(C)(C)C.Cn1cc(C(C)(F)F)nc1C(C)(C)C.Cn1nc(C(C)(C)C)nc1C(C)(F)F.Cn1nc(C(C)(F)F)nc1C(C)(C)C.[2H]C([2H])([2H])n1cc(C(C)(F)F)nc1C(C)(C)C
InChIInChI=1S/C13H21F2N3.C13H20F2N2.C12H18F2N2.C12H20F2N2.C11H17F3N2.C11H18F2N2.3C10H16F2N2.C10H17FN2.2C9H15F2N3.2C9H16FN3/c1-12(2,3)11-16-10(13(4,14)15)8-18(11)9-6-17(5)7-9;1-12(2,3)11-16-10(13(4,14)15)8-17(11)9-6-5-7-9;1-11(2,3)10-15-9(12(4,13)14)7-16(10)8-5-6-8;1-8(2)16-7-9(12(6,13)14)15-10(16)11(3,4)5;1-10(2,3)9-15-8(11(4,13)14)7-16(9)6-5-12;1-6-15-7-8(11(5,12)13)14-9(15)10(2,3)4;2*1-9(2,3)8-13-7(6-14(8)5)10(4,11)12;1-7-6-8(10(5,11)12)13-14(7)9(2,3)4;1-7-6-9(8(2)11)12-13(7)10(3,4)5;1-8(2,3)7-12-6(9(4,10)11)13-14(7)5;1-8(2,3)6-12-7(9(4,10)11)14(5)13-6;1-6(10)7-11-8(9(2,3)4)12-13(7)5;1-6(10)7-11-8(9(2,3)4)13(5)12-7/h8-9H,6-7H2,1-5H3;8-9H,5-7H2,1-4H3;7-8H,5-6H2,1-4H3;7-8H,1-6H3;7H,5-6H2,1-4H3;7H,6H2,1-5H3;3*6H,1-5H3;6,8H,1-5H3;2*1-5H3;2*6H,1-5H3/i;;;;;;5D3;;;;;;;
InChIKeyDWFDWBSJEUJGIE-SHKMAHSRSA-N
MW2979.75 g/mol
LogP41.30
Rot. Bonds22

About 2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole

2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole (PubChem CID 167562682) has the molecular formula C148H241F26N33 and a molecular weight of 2979.75 g/mol. Its IUPAC name is 2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole.

Molecular Properties

Compound Name2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole
PubChem CID167562682
Molecular FormulaC148H241F26N33
Molecular Weight2979.75 g/mol
Exact Mass2977.96
IUPAC Name2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole
SMILESCC(C)(C)c1nc(C(C)(F)F)cn1C1CC1.CC(C)(C)c1nc(C(C)(F)F)cn1C1CCC1.CC(C)(C)c1nc(C(C)(F)F)cn1CCF.CC(C)n1cc(C(C)(F)F)nc1C(C)(C)C.CC(F)c1nc(C(C)(C)C)n(C)n1.CC(F)c1nc(C(C)(C)C)nn1C.CCn1cc(C(C)(F)F)nc1C(C)(C)C.CN1CC(n2cc(C(C)(F)F)nc2C(C)(C)C)C1.Cc1cc(C(C)(F)F)nn1C(C)(C)C.Cc1cc(C(C)F)nn1C(C)(C)C.Cn1cc(C(C)(F)F)nc1C(C)(C)C.Cn1nc(C(C)(C)C)nc1C(C)(F)F.Cn1nc(C(C)(F)F)nc1C(C)(C)C.[2H]C([2H])([2H])n1cc(C(C)(F)F)nc1C(C)(C)C
InChIInChI=1S/C13H21F2N3.C13H20F2N2.C12H18F2N2.C12H20F2N2.C11H17F3N2.C11H18F2N2.3C10H16F2N2.C10H17FN2.2C9H15F2N3.2C9H16FN3/c1-12(2,3)11-16-10(13(4,14)15)8-18(11)9-6-17(5)7-9;1-12(2,3)11-16-10(13(4,14)15)8-17(11)9-6-5-7-9;1-11(2,3)10-15-9(12(4,13)14)7-16(10)8-5-6-8;1-8(2)16-7-9(12(6,13)14)15-10(16)11(3,4)5;1-10(2,3)9-15-8(11(4,13)14)7-16(9)6-5-12;1-6-15-7-8(11(5,12)13)14-9(15)10(2,3)4;2*1-9(2,3)8-13-7(6-14(8)5)10(4,11)12;1-7-6-8(10(5,11)12)13-14(7)9(2,3)4;1-7-6-9(8(2)11)12-13(7)10(3,4)5;1-8(2,3)7-12-6(9(4,10)11)13-14(7)5;1-8(2,3)6-12-7(9(4,10)11)14(5)13-6;1-6(10)7-11-8(9(2,3)4)12-13(7)5;1-6(10)7-11-8(9(2,3)4)13(5)12-7/h8-9H,6-7H2,1-5H3;8-9H,5-7H2,1-4H3;7-8H,5-6H2,1-4H3;7-8H,1-6H3;7H,5-6H2,1-4H3;7H,6H2,1-5H3;3*6H,1-5H3;6,8H,1-5H3;2*1-5H3;2*6H,1-5H3/i;;;;;;5D3;;;;;;;
InChIKeyDWFDWBSJEUJGIE-SHKMAHSRSA-N
XLogP41.30
TPSA304.28 Ų
H-Bond Donors
H-Bond Acceptors33
Rotatable Bonds22
Heavy Atoms207
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002979.75
LogP ≤ 541.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1033

Analyze 2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole?
The IUPAC name of 2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole (CID 167562682) is 2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole.
What is the SMILES notation for 2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole?
The canonical SMILES for 2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole is CC(C)(C)c1nc(C(C)(F)F)cn1C1CC1.CC(C)(C)c1nc(C(C)(F)F)cn1C1CCC1.CC(C)(C)c1nc(C(C)(F)F)cn1CCF.CC(C)n1cc(C(C)(F)F)nc1C(C)(C)C.CC(F)c1nc(C(C)(C)C)n(C)n1.CC(F)c1nc(C(C)(C)C)nn1C.CCn1cc(C(C)(F)F)nc1C(C)(C)C.CN1CC(n2cc(C(C)(F)F)nc2C(C)(C)C)C1.Cc1cc(C(C)(F)F)nn1C(C)(C)C.Cc1cc(C(C)F)nn1C(C)(C)C.Cn1cc(C(C)(F)F)nc1C(C)(C)C.Cn1nc(C(C)(C)C)nc1C(C)(F)F.Cn1nc(C(C)(F)F)nc1C(C)(C)C.[2H]C([2H])([2H])n1cc(C(C)(F)F)nc1C(C)(C)C.
What is the InChIKey of 2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole?
The InChIKey is DWFDWBSJEUJGIE-SHKMAHSRSA-N. The full InChI is InChI=1S/C13H21F2N3.C13H20F2N2.C12H18F2N2.C12H20F2N2.C11H17F3N2.C11H18F2N2.3C10H16F2N2.C10H17FN2.2C9H15F2N3.2C9H16FN3/c1-12(2,3)11-16-10(13(4,14)15)8-18(11)9-6-17(5)7-9;1-12(2,3)11-16-10(13(4,14)15)8-17(11)9-6-5-7-9;1-11(2,3)10-15-9(12(4,13)14)7-16(10)8-5-6-8;1-8(2)16-7-9(12(6,13)14)15-10(16)11(3,4)5;1-10(2,3)9-15-8(11(4,13)14)7-16(9)6-5-12;1-6-15-7-8(11(5,12)13)14-9(15)10(2,3)4;2*1-9(2,3)8-13-7(6-14(8)5)10(4,11)12;1-7-6-8(10(5,11)12)13-14(7)9(2,3)4;1-7-6-9(8(2)11)12-13(7)10(3,4)5;1-8(2,3)7-12-6(9(4,10)11)13-14(7)5;1-8(2,3)6-12-7(9(4,10)11)14(5)13-6;1-6(10)7-11-8(9(2,3)4)12-13(7)5;1-6(10)7-11-8(9(2,3)4)13(5)12-7/h8-9H,6-7H2,1-5H3;8-9H,5-7H2,1-4H3;7-8H,5-6H2,1-4H3;7-8H,1-6H3;7H,5-6H2,1-4H3;7H,6H2,1-5H3;3*6H,1-5H3;6,8H,1-5H3;2*1-5H3;2*6H,1-5H3/i;;;;;;5D3;;;;;;;.
What are the key properties of 2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole?
2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole has a molecular weight of 2979.75 g/mol, XLogP of 41.30, 22 rotatable bonds, 0 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-1-cyclobutyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-1-cyclopropyl-4-(1,1-difluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-ethylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(2-fluoroethyl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(1-methylazetidin-3-yl)imidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-methylimidazole;1-tert-butyl-3-(1,1-difluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1,1-difluoroethyl)-1-methyl-1,2,4-triazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-propan-2-ylimidazole;2-tert-butyl-4-(1,1-difluoroethyl)-1-(trideuteriomethyl)imidazole;1-tert-butyl-3-(1-fluoroethyl)-5-methylpyrazole;3-tert-butyl-5-(1-fluoroethyl)-1-methyl-1,2,4-triazole;5-tert-butyl-3-(1-fluoroethyl)-1-methyl-1,2,4-triazole is sourced from PubChem (CID 167562682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).