4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine

C167H265F9N20O7S2+2 — CID 159197491

IUPAC4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine
SMILESCC(C)(C)C1CCC(F)(F)CC1.CC(C)(C)C1CCN(c2cccc(F)n2)CC1.CC(C)(C)C1CCOCC1.CC(C)(C)CC(=O)N1CCC(C(C)(C)C)CC1.CC(C)(C)c1ccc(C(F)(F)F)cn1.CC(C)(C)c1ccc(F)c[n+]1O.CC(C)(C)c1ccc(F)nc1.CC(C)(C)c1cccc[n+]1O.CC(C)(C)c1ccncn1.CC(C)(C)c1cncc(F)c1.CCS(=O)(=O)c1cccc(C(C)(C)C)n1.COc1ccc(C(C)(C)C)cn1.CSc1cccc(C(C)(C)C)n1.Cc1ccc(C(C)(C)C)cn1.Cn1cc(C(C)(C)C)cn1.Cn1ccnc1C(C)(C)C.Cn1cncc1C(C)(C)C
InChIInChI=1S/C15H29NO.C14H21FN2.C11H17NO2S.C10H12F3N.C10H18F2.C10H15NO.C10H15NS.C10H15N.C9H13FNO.2C9H12FN.C9H14NO.C9H18O.3C8H14N2.C8H12N2/c1-14(2,3)11-13(17)16-9-7-12(8-10-16)15(4,5)6;1-14(2,3)11-7-9-17(10-8-11)13-6-4-5-12(15)16-13;1-5-15(13,14)10-8-6-7-9(12-10)11(2,3)4;1-9(2,3)8-5-4-7(6-14-8)10(11,12)13;1-9(2,3)8-4-6-10(11,12)7-5-8;1-10(2,3)8-5-6-9(12-4)11-7-8;1-10(2,3)8-6-5-7-9(11-8)12-4;1-8-5-6-9(7-11-8)10(2,3)4;1-9(2,3)8-5-4-7(10)6-11(8)12;1-9(2,3)7-4-8(10)6-11-5-7;1-9(2,3)7-4-5-8(10)11-6-7;1-9(2,3)8-6-4-5-7-10(8)11;1-9(2,3)8-4-6-10-7-5-8;1-8(2,3)7-5-9-6-10(7)4;1-8(2,3)7-5-9-10(4)6-7;1-8(2,3)7-9-5-6-10(7)4;1-8(2,3)7-4-5-9-6-10-7/h12H,7-11H2,1-6H3;4-6,11H,7-10H2,1-3H3;6-8H,5H2,1-4H3;4-6H,1-3H3;8H,4-7H2,1-3H3;2*5-7H,1-4H3;5-7H,1-4H3;4-6,12H,1-3H3;2*4-6H,1-3H3;4-7,11H,1-3H3;8H,4-7H2,1-3H3;3*5-6H,1-4H3;4-6H,1-3H3/q;;;;;;;;+1;;;+1;;;;;
InChIKeyAEZLLKMNIDPKKL-UHFFFAOYSA-N
MW2900.21 g/mol
LogP42.37
Rot. Bonds6

About 4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine

4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine (PubChem CID 159197491) has the molecular formula C167H265F9N20O7S2+2 and a molecular weight of 2900.21 g/mol. Its IUPAC name is 4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine
PubChem CID159197491
Molecular FormulaC167H265F9N20O7S2+2
Molecular Weight2900.21 g/mol
Exact Mass2898.03
IUPAC Name4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine
SMILESCC(C)(C)C1CCC(F)(F)CC1.CC(C)(C)C1CCN(c2cccc(F)n2)CC1.CC(C)(C)C1CCOCC1.CC(C)(C)CC(=O)N1CCC(C(C)(C)C)CC1.CC(C)(C)c1ccc(C(F)(F)F)cn1.CC(C)(C)c1ccc(F)c[n+]1O.CC(C)(C)c1ccc(F)nc1.CC(C)(C)c1cccc[n+]1O.CC(C)(C)c1ccncn1.CC(C)(C)c1cncc(F)c1.CCS(=O)(=O)c1cccc(C(C)(C)C)n1.COc1ccc(C(C)(C)C)cn1.CSc1cccc(C(C)(C)C)n1.Cc1ccc(C(C)(C)C)cn1.Cn1cc(C(C)(C)C)cn1.Cn1ccnc1C(C)(C)C.Cn1cncc1C(C)(C)C
InChIInChI=1S/C15H29NO.C14H21FN2.C11H17NO2S.C10H12F3N.C10H18F2.C10H15NO.C10H15NS.C10H15N.C9H13FNO.2C9H12FN.C9H14NO.C9H18O.3C8H14N2.C8H12N2/c1-14(2,3)11-13(17)16-9-7-12(8-10-16)15(4,5)6;1-14(2,3)11-7-9-17(10-8-11)13-6-4-5-12(15)16-13;1-5-15(13,14)10-8-6-7-9(12-10)11(2,3)4;1-9(2,3)8-5-4-7(6-14-8)10(11,12)13;1-9(2,3)8-4-6-10(11,12)7-5-8;1-10(2,3)8-5-6-9(12-4)11-7-8;1-10(2,3)8-6-5-7-9(11-8)12-4;1-8-5-6-9(7-11-8)10(2,3)4;1-9(2,3)8-5-4-7(10)6-11(8)12;1-9(2,3)7-4-8(10)6-11-5-7;1-9(2,3)7-4-5-8(10)11-6-7;1-9(2,3)8-6-4-5-7-10(8)11;1-9(2,3)8-4-6-10-7-5-8;1-8(2,3)7-5-9-6-10(7)4;1-8(2,3)7-5-9-10(4)6-7;1-8(2,3)7-9-5-6-10(7)4;1-8(2,3)7-4-5-9-6-10-7/h12H,7-11H2,1-6H3;4-6,11H,7-10H2,1-3H3;6-8H,5H2,1-4H3;4-6H,1-3H3;8H,4-7H2,1-3H3;2*5-7H,1-4H3;5-7H,1-4H3;4-6,12H,1-3H3;2*4-6H,1-3H3;4-7,11H,1-3H3;8H,4-7H2,1-3H3;3*5-6H,1-4H3;4-6H,1-3H3/q;;;;;;;;+1;;;+1;;;;;
InChIKeyAEZLLKMNIDPKKL-UHFFFAOYSA-N
XLogP42.37
TPSA306.73 Ų
H-Bond Donors2
H-Bond Acceptors25
Rotatable Bonds6
Heavy Atoms205
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002900.21
LogP ≤ 542.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine with MolForge

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Launch Full Analysis

Related Compounds

4-Tert-butyl-1,1-difluorocyclohexane;tert-butyl 4-(3,3-dimethylbutyl)piperidine-1-carboxylate;4-(3,3-dimethylbutyl)piperidine;2-(2,2-dimethylpropyl)-6-ethylsulfonylpyridine;5-(2,2-dimethylpropyl)-2-methoxypyridine;2-(2,2-dimethylpropyl)-1-methylimidazole;5-(2,2-dimethylpropyl)-1-methylimidazole;4-(2,2-dimethylpropyl)-1-methylpyrazole;4-(2,2-dimethylpropyl)pyrimidine
CID 160506713
Tert-butyl 4-tert-butylpiperidine-1-carboxylate;4-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-2,2-difluoropiperidine;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;2-tert-butyl-6-methylsulfonylpyridine;4-tert-butylmorpholine;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;1-tert-butyl-4-pyridin-2-ylpiperazine;4-tert-butylpyrimidine;1-tert-butyl-4-(trifluoromethyl)piperidine;2-tert-butyl-5-(trifluoromethyl)pyridine
CID 161370062

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine?
The IUPAC name of 4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine (CID 159197491) is 4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine?
The canonical SMILES for 4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine is CC(C)(C)C1CCC(F)(F)CC1.CC(C)(C)C1CCN(c2cccc(F)n2)CC1.CC(C)(C)C1CCOCC1.CC(C)(C)CC(=O)N1CCC(C(C)(C)C)CC1.CC(C)(C)c1ccc(C(F)(F)F)cn1.CC(C)(C)c1ccc(F)c[n+]1O.CC(C)(C)c1ccc(F)nc1.CC(C)(C)c1cccc[n+]1O.CC(C)(C)c1ccncn1.CC(C)(C)c1cncc(F)c1.CCS(=O)(=O)c1cccc(C(C)(C)C)n1.COc1ccc(C(C)(C)C)cn1.CSc1cccc(C(C)(C)C)n1.Cc1ccc(C(C)(C)C)cn1.Cn1cc(C(C)(C)C)cn1.Cn1ccnc1C(C)(C)C.Cn1cncc1C(C)(C)C.
What is the InChIKey of 4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine?
The InChIKey is AEZLLKMNIDPKKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO.C14H21FN2.C11H17NO2S.C10H12F3N.C10H18F2.C10H15NO.C10H15NS.C10H15N.C9H13FNO.2C9H12FN.C9H14NO.C9H18O.3C8H14N2.C8H12N2/c1-14(2,3)11-13(17)16-9-7-12(8-10-16)15(4,5)6;1-14(2,3)11-7-9-17(10-8-11)13-6-4-5-12(15)16-13;1-5-15(13,14)10-8-6-7-9(12-10)11(2,3)4;1-9(2,3)8-5-4-7(6-14-8)10(11,12)13;1-9(2,3)8-4-6-10(11,12)7-5-8;1-10(2,3)8-5-6-9(12-4)11-7-8;1-10(2,3)8-6-5-7-9(11-8)12-4;1-8-5-6-9(7-11-8)10(2,3)4;1-9(2,3)8-5-4-7(10)6-11(8)12;1-9(2,3)7-4-8(10)6-11-5-7;1-9(2,3)7-4-5-8(10)11-6-7;1-9(2,3)8-6-4-5-7-10(8)11;1-9(2,3)8-4-6-10-7-5-8;1-8(2,3)7-5-9-6-10(7)4;1-8(2,3)7-5-9-10(4)6-7;1-8(2,3)7-9-5-6-10(7)4;1-8(2,3)7-4-5-9-6-10-7/h12H,7-11H2,1-6H3;4-6,11H,7-10H2,1-3H3;6-8H,5H2,1-4H3;4-6H,1-3H3;8H,4-7H2,1-3H3;2*5-7H,1-4H3;5-7H,1-4H3;4-6,12H,1-3H3;2*4-6H,1-3H3;4-7,11H,1-3H3;8H,4-7H2,1-3H3;3*5-6H,1-4H3;4-6H,1-3H3/q;;;;;;;;+1;;;+1;;;;;.
What are the key properties of 4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine?
4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine has a molecular weight of 2900.21 g/mol, XLogP of 42.37, 6 rotatable bonds, 2 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-1,1-difluorocyclohexane;2-tert-butyl-6-ethylsulfonylpyridine;2-tert-butyl-5-fluoro-1-hydroxypyridin-1-ium;3-tert-butyl-5-fluoropyridine;5-tert-butyl-2-fluoropyridine;2-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-2-methoxypyridine;2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methylpyridine;2-tert-butyl-6-methylsulfanylpyridine;4-tert-butyloxane;1-(4-tert-butylpiperidin-1-yl)-3,3-dimethylbutan-1-one;2-(4-tert-butylpiperidin-1-yl)-6-fluoropyridine;4-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 159197491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).