2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine

C255H414N30O17S4 — CID 159755686

IUPAC2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine
SMILESCC(C)(C)c1cccnc1.CC(C)(C)c1cccnn1.CC(C)(C)c1ccoc1.CC(C)c1ncc(C(C)(C)C)cn1.CC1=CC(C(C)(C)C)=CC1.CC1=NC(C(C)(C)C)=CC1.CCc1coc(C(C)(C)C)c1.CCc1noc(C(C)(C)C)c1C.COCc1noc(C(C)(C)C)c1C.Cc1c(C(C)C)noc1C(C)(C)C.Cc1cc(C(C)(C)C)no1.Cc1cc(C(C)(C)C)on1.Cc1ccc(C(C)(C)C)o1.Cc1ccc(C(C)(C)C)o1.Cc1ccc(C(C)(C)C)o1.Cc1ccc(C(C)(C)C)o1.Cc1cnc(C(C)(C)C)o1.Cc1cnc(C(C)(C)C)s1.Cc1coc(C(C)(C)C)c1.Cc1coc(C(C)(C)C)c1C.Cc1coc(C(C)(C)C)n1.Cc1nc(C(C)(C)C)cs1.Cc1ncc(C(C)(C)C)c(C)n1.Cc1ncc(C(C)(C)C)cn1.Cc1ncc(C(C)(C)C)s1.Cc1nnc(C(C)(C)C)s1.Cc1noc(C(C)(C)C)c1C.Cn1cc(C(C)(C)C)nn1.Cn1nnc(C(C)(C)C)n1
InChIInChI=1S/C11H18N2.C11H19NO.C10H16N2.C10H17NO2.C10H17NO.2C10H16O.C10H16.C9H14N2.C9H15NO.C9H15N.C9H13N.5C9H14O.C8H12N2.4C8H13NO.3C8H13NS.C8H12O.C7H13N3.C7H12N2S.C6H12N4/c1-8(2)10-12-6-9(7-13-10)11(3,4)5;1-7(2)9-8(3)10(13-12-9)11(4,5)6;1-7-9(10(3,4)5)6-11-8(2)12-7;1-7-8(6-12-5)11-13-9(7)10(2,3)4;1-6-8-7(2)9(12-11-8)10(3,4)5;1-7-6-11-9(8(7)2)10(3,4)5;1-5-8-6-9(11-7-8)10(2,3)4;1-8-5-6-9(7-8)10(2,3)4;1-7-10-5-8(6-11-7)9(2,3)4;1-6-7(2)10-11-8(6)9(3,4)5;1-7-5-6-8(10-7)9(2,3)4;1-9(2,3)8-5-4-6-10-7-8;1-7-5-8(10-6-7)9(2,3)4;4*1-7-5-6-8(10-7)9(2,3)4;1-8(2,3)7-5-4-6-9-10-7;1-6-5-10-7(9-6)8(2,3)4;1-6-5-9-7(10-6)8(2,3)4;1-6-5-7(9-10-6)8(2,3)4;1-6-5-7(10-9-6)8(2,3)4;1-6-9-7(5-10-6)8(2,3)4;1-6-9-5-7(10-6)8(2,3)4;1-6-5-9-7(10-6)8(2,3)4;1-8(2,3)7-4-5-9-6-7;1-7(2,3)6-5-10(4)9-8-6;1-5-8-9-6(10-5)7(2,3)4;1-6(2,3)5-7-9-10(4)8-5/h6-8H,1-5H3;7H,1-6H3;6H,1-5H3;6H2,1-5H3;6H2,1-5H3;6H,1-5H3;6-7H,5H2,1-4H3;6-7H,5H2,1-4H3;5-6H,1-4H3;1-5H3;6H,5H2,1-4H3;4-7H,1-3H3;5*5-6H,1-4H3;4-6H,1-3H3;7*5H,1-4H3;4-6H,1-3H3;5H,1-4H3;2*1-4H3
InChIKeyNEFOWOKOYIYKGY-UHFFFAOYSA-N
MW4300.58 g/mol
LogP73.35
Rot. Bonds6

About 2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine

2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine (PubChem CID 159755686) has the molecular formula C255H414N30O17S4 and a molecular weight of 4300.58 g/mol. Its IUPAC name is 2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine.

Molecular Properties

Compound Name2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine
PubChem CID159755686
Molecular FormulaC255H414N30O17S4
Molecular Weight4300.58 g/mol
Exact Mass4297.13
IUPAC Name2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine
SMILESCC(C)(C)c1cccnc1.CC(C)(C)c1cccnn1.CC(C)(C)c1ccoc1.CC(C)c1ncc(C(C)(C)C)cn1.CC1=CC(C(C)(C)C)=CC1.CC1=NC(C(C)(C)C)=CC1.CCc1coc(C(C)(C)C)c1.CCc1noc(C(C)(C)C)c1C.COCc1noc(C(C)(C)C)c1C.Cc1c(C(C)C)noc1C(C)(C)C.Cc1cc(C(C)(C)C)no1.Cc1cc(C(C)(C)C)on1.Cc1ccc(C(C)(C)C)o1.Cc1ccc(C(C)(C)C)o1.Cc1ccc(C(C)(C)C)o1.Cc1ccc(C(C)(C)C)o1.Cc1cnc(C(C)(C)C)o1.Cc1cnc(C(C)(C)C)s1.Cc1coc(C(C)(C)C)c1.Cc1coc(C(C)(C)C)c1C.Cc1coc(C(C)(C)C)n1.Cc1nc(C(C)(C)C)cs1.Cc1ncc(C(C)(C)C)c(C)n1.Cc1ncc(C(C)(C)C)cn1.Cc1ncc(C(C)(C)C)s1.Cc1nnc(C(C)(C)C)s1.Cc1noc(C(C)(C)C)c1C.Cn1cc(C(C)(C)C)nn1.Cn1nnc(C(C)(C)C)n1
InChIInChI=1S/C11H18N2.C11H19NO.C10H16N2.C10H17NO2.C10H17NO.2C10H16O.C10H16.C9H14N2.C9H15NO.C9H15N.C9H13N.5C9H14O.C8H12N2.4C8H13NO.3C8H13NS.C8H12O.C7H13N3.C7H12N2S.C6H12N4/c1-8(2)10-12-6-9(7-13-10)11(3,4)5;1-7(2)9-8(3)10(13-12-9)11(4,5)6;1-7-9(10(3,4)5)6-11-8(2)12-7;1-7-8(6-12-5)11-13-9(7)10(2,3)4;1-6-8-7(2)9(12-11-8)10(3,4)5;1-7-6-11-9(8(7)2)10(3,4)5;1-5-8-6-9(11-7-8)10(2,3)4;1-8-5-6-9(7-8)10(2,3)4;1-7-10-5-8(6-11-7)9(2,3)4;1-6-7(2)10-11-8(6)9(3,4)5;1-7-5-6-8(10-7)9(2,3)4;1-9(2,3)8-5-4-6-10-7-8;1-7-5-8(10-6-7)9(2,3)4;4*1-7-5-6-8(10-7)9(2,3)4;1-8(2,3)7-5-4-6-9-10-7;1-6-5-10-7(9-6)8(2,3)4;1-6-5-9-7(10-6)8(2,3)4;1-6-5-7(9-10-6)8(2,3)4;1-6-5-7(10-9-6)8(2,3)4;1-6-9-7(5-10-6)8(2,3)4;1-6-9-5-7(10-6)8(2,3)4;1-6-5-9-7(10-6)8(2,3)4;1-8(2,3)7-4-5-9-6-7;1-7(2,3)6-5-10(4)9-8-6;1-5-8-9-6(10-5)7(2,3)4;1-6(2,3)5-7-9-10(4)8-5/h6-8H,1-5H3;7H,1-6H3;6H,1-5H3;6H2,1-5H3;6H2,1-5H3;6H,1-5H3;6-7H,5H2,1-4H3;6-7H,5H2,1-4H3;5-6H,1-4H3;1-5H3;6H,5H2,1-4H3;4-7H,1-3H3;5*5-6H,1-4H3;4-6H,1-3H3;7*5H,1-4H3;4-6H,1-3H3;5H,1-4H3;2*1-4H3
InChIKeyNEFOWOKOYIYKGY-UHFFFAOYSA-N
XLogP73.35
TPSA589.72 Ų
H-Bond Donors
H-Bond Acceptors51
Rotatable Bonds6
Heavy Atoms306
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004300.58
LogP ≤ 573.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1051

Analyze 2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine with MolForge

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Launch Full Analysis

Related Compounds

1-Benzyl-4-propan-2-ylpyrazole;5-tert-butyl-3-(difluoromethyl)-1,2,4-oxadiazole;4-tert-butyl-1-(2,2-difluoropropyl)pyrazole;2-tert-butyl-4-methylfuran;2-tert-butyl-5-methylfuran;2-tert-butyl-4-methyl-1,3-oxazole;5-tert-butyl-2-methyl-1,3-thiazole;2-tert-butyl-4-methylthiophene;5-tert-butyl-3-(2,2,2-trifluoroethyl)-1,2,4-oxadiazole;5-tert-butyl-3-(2,2,2-trifluoroethyl)-1,2-oxazole;1,3-dimethyl-4-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,4-di(propan-2-yl)pyrazole;1,3-di(propan-2-yl)-1,2,4-triazole;2-fluoro-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-oxazole;(5-propan-2-yl-1,2-oxazol-3-yl)methanol;4-[2-(4-propan-2-ylpyrazol-1-yl)ethyl]morpholine;3-propan-2-ylpyridine
CID 157067177
CID 157298273
CID 157298273
1-Benzyl-4-propan-2-ylpyrazole;5-tert-butyl-3-(difluoromethyl)-1,2,4-oxadiazole;4-tert-butyl-1-(2,2-difluoropropyl)pyrazole;2-tert-butyl-4-methylfuran;2-tert-butyl-5-methylfuran;2-tert-butyl-4-methyl-1,3-oxazole;5-tert-butyl-2-methyl-1,3-thiazole;2-tert-butyl-4-methylthiophene;bis(5-tert-butyl-3-(2,2,2-trifluoroethyl)-1,2-oxazole);1,3-dimethyl-4-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,4-di(propan-2-yl)pyrazole;1,3-di(propan-2-yl)-1,2,4-triazole;2-fluoro-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-oxazole;(5-propan-2-yl-1,2-oxazol-3-yl)methanol;4-[2-(4-propan-2-ylpyrazol-1-yl)ethyl]morpholine;3-propan-2-ylpyridine
CID 157501942
N-(1-cyclopropylethyl)-2-methylpropan-1-amine;2,3-dimethylbutan-2-ol;2,2-dimethyl-N-[2-(2-methylpropylamino)ethyl]propanamide;2,2-dimethyl-N-(2-methylpropyl)propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[(3-methyloxetan-3-yl)methyl]propan-1-amine;2-methyl-2-(2-methylpropylamino)propan-1-ol;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;N-(2-methylpropyl)oxan-4-amine;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine;2,2,2-trifluoro-N-[2-(2-methylpropylamino)ethyl]acetamide
CID 157544264
3-Tert-butyl-1-methylpyrazole;3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;5-tert-butyl-3-(trifluoromethyl)-1,2-oxazole;3-cyclopropyl-2-methyl-5-propan-2-yl-1,2,4-oxadiazol-2-ium;1,5-dimethyl-4-propan-2-ylpyrazole;5-methyl-4-propan-2-yl-1,2-oxazole;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;(5-propan-2-yl-1,2-oxazol-3-yl)methanol;1-propan-2-yl-1,2,4-triazole
CID 157545873
3-tert-butyl-1-methylpyrazole;3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;5-tert-butyl-3-(trifluoromethyl)-1,2-oxazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2-oxazole;1-ethyl-4-propan-2-ylpyrazole;methane;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;(5-propan-2-yl-1,2-oxazol-3-yl)methanol;1-propan-2-ylpyrazole;4-[(4-propan-2-ylpyrazol-1-yl)methyl]pyridine;1-propan-2-yl-1,2,4-triazole
CID 157603729
5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-1-methylpyrrole;4-tert-butyl-2-methyltriazole;1-(5-tert-butyl-1,2-oxazol-3-yl)-N,N-dimethylethenamine;5-tert-butyl-3-propyl-1,2-oxazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;5-propan-2-yl-1,2-oxazole;1-propan-2-ylpyrazole
CID 157658282
CID 157902277
CID 157902277
5-Tert-butyl-3-(2,2-difluoropropyl)-1,2-oxazole;4-tert-butyl-1-(2,2-difluoropropyl)pyrazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-4-methylfuran;2-tert-butyl-5-methylfuran;2-tert-butyl-4-methyl-1,3-oxazole;5-tert-butyl-2-methyl-1,3-thiazole;2-tert-butyl-4-methylthiophene;1,3-dimethyl-4-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,4-di(propan-2-yl)pyrazole;1,3-di(propan-2-yl)-1,2,4-triazole;3-ethyl-5-propan-2-yl-1,2-oxazole;4-[2-(4-propan-2-ylpyrazol-1-yl)ethyl]morpholine
CID 157916697
2-chloro-3-propan-2-ylpyridine;2-chloro-4-propan-2-ylpyridine;2-chloro-5-propan-2-ylpyridine;2,5-dimethyl-4-propan-2-yl-1,3-oxazole;2,5-dimethyl-3-propan-2-yl-2H-pyrrole;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-ylfuran;3-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;bis(5-propan-2-yl-1H-pyrazole);2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;2-propan-2-yl-1,3,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;5-propan-2-yl-1,3-thiazole;2-propan-2-yl-4-(trifluoromethyl)pyridine;2-propan-2-yl-6-(trifluoromethyl)pyridine
CID 158019428
cumene;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;1,3-dimethyl-4-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,2-dimethyl-3-propan-2-ylpyrrole;1,4-di(propan-2-yl)pyrazole;1-ethyl-4-propan-2-ylpyrazole;2-ethyl-5-propan-2-ylthiophene;1-methyl-3-propan-2-ylbenzene;4-methyl-2-propan-2-ylfuran;4-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-1-propan-2-ylpyrazole;4-methyl-1-propan-2-ylpyrazole;1-methyl-3-propan-2-ylpyrrole;2-methyl-5-propan-2-yl-3H-pyrrole;3-methyl-1-propan-2-ylpyrrole;2-methyl-5-propan-2-yl-1,3-thiazole;5-propan-2-yl-3-propyl-1,2,4-oxadiazole;bis(1-propan-2-ylpyrazole);2-[(4-propan-2-ylpyrazol-1-yl)methyl]pyridine;3-propan-2-ylpyridine;4-propan-2-yl-1-(2,2,2-trifluoroethyl)pyrazole
CID 158110433
1-Benzyl-4-propan-2-ylpyrazole;5-tert-butyl-2-methyl-1,3-oxazole;3-cyclopropyl-5-propan-2-yl-1,2-oxazole;1-(2,2-difluoropropyl)-4-propan-2-ylpyrazole;1,3-dimethyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yltriazole;3,5-dimethyl-1-propan-2-yl-1,2,4-triazole;1-ethyl-4-propan-2-yltriazole;2-fluoro-4-propan-2-ylpyridine;4-methyl-1-propan-2-ylimidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-4-propan-2-yltriazole;3-methyl-1-propan-2-yl-1,2,4-triazole;1-propan-2-ylpyrazole;4-[2-(4-propan-2-ylpyrazol-1-yl)ethyl]morpholine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-1,2,4-triazole
CID 158159608

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine?
The IUPAC name of 2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine (CID 159755686) is 2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine.
What is the SMILES notation for 2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine?
The canonical SMILES for 2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine is CC(C)(C)c1cccnc1.CC(C)(C)c1cccnn1.CC(C)(C)c1ccoc1.CC(C)c1ncc(C(C)(C)C)cn1.CC1=CC(C(C)(C)C)=CC1.CC1=NC(C(C)(C)C)=CC1.CCc1coc(C(C)(C)C)c1.CCc1noc(C(C)(C)C)c1C.COCc1noc(C(C)(C)C)c1C.Cc1c(C(C)C)noc1C(C)(C)C.Cc1cc(C(C)(C)C)no1.Cc1cc(C(C)(C)C)on1.Cc1ccc(C(C)(C)C)o1.Cc1ccc(C(C)(C)C)o1.Cc1ccc(C(C)(C)C)o1.Cc1ccc(C(C)(C)C)o1.Cc1cnc(C(C)(C)C)o1.Cc1cnc(C(C)(C)C)s1.Cc1coc(C(C)(C)C)c1.Cc1coc(C(C)(C)C)c1C.Cc1coc(C(C)(C)C)n1.Cc1nc(C(C)(C)C)cs1.Cc1ncc(C(C)(C)C)c(C)n1.Cc1ncc(C(C)(C)C)cn1.Cc1ncc(C(C)(C)C)s1.Cc1nnc(C(C)(C)C)s1.Cc1noc(C(C)(C)C)c1C.Cn1cc(C(C)(C)C)nn1.Cn1nnc(C(C)(C)C)n1.
What is the InChIKey of 2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine?
The InChIKey is NEFOWOKOYIYKGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2.C11H19NO.C10H16N2.C10H17NO2.C10H17NO.2C10H16O.C10H16.C9H14N2.C9H15NO.C9H15N.C9H13N.5C9H14O.C8H12N2.4C8H13NO.3C8H13NS.C8H12O.C7H13N3.C7H12N2S.C6H12N4/c1-8(2)10-12-6-9(7-13-10)11(3,4)5;1-7(2)9-8(3)10(13-12-9)11(4,5)6;1-7-9(10(3,4)5)6-11-8(2)12-7;1-7-8(6-12-5)11-13-9(7)10(2,3)4;1-6-8-7(2)9(12-11-8)10(3,4)5;1-7-6-11-9(8(7)2)10(3,4)5;1-5-8-6-9(11-7-8)10(2,3)4;1-8-5-6-9(7-8)10(2,3)4;1-7-10-5-8(6-11-7)9(2,3)4;1-6-7(2)10-11-8(6)9(3,4)5;1-7-5-6-8(10-7)9(2,3)4;1-9(2,3)8-5-4-6-10-7-8;1-7-5-8(10-6-7)9(2,3)4;4*1-7-5-6-8(10-7)9(2,3)4;1-8(2,3)7-5-4-6-9-10-7;1-6-5-10-7(9-6)8(2,3)4;1-6-5-9-7(10-6)8(2,3)4;1-6-5-7(9-10-6)8(2,3)4;1-6-5-7(10-9-6)8(2,3)4;1-6-9-7(5-10-6)8(2,3)4;1-6-9-5-7(10-6)8(2,3)4;1-6-5-9-7(10-6)8(2,3)4;1-8(2,3)7-4-5-9-6-7;1-7(2,3)6-5-10(4)9-8-6;1-5-8-9-6(10-5)7(2,3)4;1-6(2,3)5-7-9-10(4)8-5/h6-8H,1-5H3;7H,1-6H3;6H,1-5H3;6H2,1-5H3;6H2,1-5H3;6H,1-5H3;6-7H,5H2,1-4H3;6-7H,5H2,1-4H3;5-6H,1-4H3;1-5H3;6H,5H2,1-4H3;4-7H,1-3H3;5*5-6H,1-4H3;4-6H,1-3H3;7*5H,1-4H3;4-6H,1-3H3;5H,1-4H3;2*1-4H3.
What are the key properties of 2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine?
2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine has a molecular weight of 4300.58 g/mol, XLogP of 73.35, 6 rotatable bonds, 0 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-3,4-dimethylfuran;5-tert-butyl-3,4-dimethyl-1,2-oxazole;5-tert-butyl-2,4-dimethylpyrimidine;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-ethyl-4-methyl-1,2-oxazole;3-tert-butylfuran;5-tert-butyl-3-(methoxymethyl)-4-methyl-1,2-oxazole;3-tert-butyl-1-methylcyclopenta-1,3-diene;2-tert-butyl-4-methylfuran;tetrakis(2-tert-butyl-5-methylfuran);2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;5-tert-butyl-4-methyl-3-propan-2-yl-1,2-oxazole;5-tert-butyl-2-methylpyrimidine;5-tert-butyl-2-methyl-3H-pyrrole;5-tert-butyl-2-methyltetrazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2-methyl-1,3-thiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-methyltriazole;5-tert-butyl-2-propan-2-ylpyrimidine;3-tert-butylpyridazine;3-tert-butylpyridine is sourced from PubChem (CID 159755686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).