4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene

C109H181N9O6S4 — CID 159263106

IUPAC4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene
SMILESCC(C)(C)c1cccc(C(C)(C)C)n1.CC(C)c1cc(C(C)(C)C)co1.CC(C)c1cc(C(C)(C)C)cs1.CC(C)c1ccc(C(C)C)o1.CC(C)c1ccc(C(C)C)s1.CC(C)c1cnc(C(C)C)o1.CC(C)c1cnc(C(C)C)s1.CC(C)c1nc(C(C)(C)C)co1.CC(C)c1nc(C(C)(C)C)cs1.CC(C)c1nnc(C(C)C)o1.CC(C)c1noc(C(C)C)n1
InChIInChI=1S/C13H21N.C11H18O.C11H18S.C10H17NO.C10H17NS.C10H16O.C10H16S.C9H15NO.C9H15NS.2C8H14N2O/c1-12(2,3)10-8-7-9-11(14-10)13(4,5)6;2*1-8(2)10-6-9(7-12-10)11(3,4)5;2*1-7(2)9-11-8(6-12-9)10(3,4)5;2*1-7(2)9-5-6-10(11-9)8(3)4;2*1-6(2)8-5-10-9(11-8)7(3)4;1-5(2)7-9-10-8(11-7)6(3)4;1-5(2)7-9-8(6(3)4)11-10-7/h7-9H,1-6H3;2*6-8H,1-5H3;2*6-7H,1-5H3;2*5-8H,1-4H3;2*5-7H,1-4H3;2*5-6H,1-4H3
InChIKeyKWTIYIYJWCTRPM-UHFFFAOYSA-N
MW1841.97 g/mol
LogP36.67
Rot. Bonds16

About 4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene

4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene (PubChem CID 159263106) has the molecular formula C109H181N9O6S4 and a molecular weight of 1841.97 g/mol. Its IUPAC name is 4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene.

Molecular Properties

Compound Name4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene
PubChem CID159263106
Molecular FormulaC109H181N9O6S4
Molecular Weight1841.97 g/mol
Exact Mass1840.30
IUPAC Name4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene
SMILESCC(C)(C)c1cccc(C(C)(C)C)n1.CC(C)c1cc(C(C)(C)C)co1.CC(C)c1cc(C(C)(C)C)cs1.CC(C)c1ccc(C(C)C)o1.CC(C)c1ccc(C(C)C)s1.CC(C)c1cnc(C(C)C)o1.CC(C)c1cnc(C(C)C)s1.CC(C)c1nc(C(C)(C)C)co1.CC(C)c1nc(C(C)(C)C)cs1.CC(C)c1nnc(C(C)C)o1.CC(C)c1noc(C(C)C)n1
InChIInChI=1S/C13H21N.C11H18O.C11H18S.C10H17NO.C10H17NS.C10H16O.C10H16S.C9H15NO.C9H15NS.2C8H14N2O/c1-12(2,3)10-8-7-9-11(14-10)13(4,5)6;2*1-8(2)10-6-9(7-12-10)11(3,4)5;2*1-7(2)9-11-8(6-12-9)10(3,4)5;2*1-7(2)9-5-6-10(11-9)8(3)4;2*1-6(2)8-5-10-9(11-8)7(3)4;1-5(2)7-9-10-8(11-7)6(3)4;1-5(2)7-9-8(6(3)4)11-10-7/h7-9H,1-6H3;2*6-8H,1-5H3;2*6-7H,1-5H3;2*5-8H,1-4H3;2*5-7H,1-4H3;2*5-6H,1-4H3
InChIKeyKWTIYIYJWCTRPM-UHFFFAOYSA-N
XLogP36.67
TPSA194.85 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds16
Heavy Atoms128
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001841.97
LogP ≤ 536.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene 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
2-(1,1-difluoroethyl)-5-[4,5-di(propan-2-yl)thiophen-2-yl]-1,3,4-oxadiazole;2,3-di(propan-2-yl)thiophene;3-[4,5-di(propan-2-yl)thiophen-2-yl]-5-methyl-1,2,4-oxadiazole;5-[4,5-di(propan-2-yl)thiophen-2-yl]-N-methyl-1,3-oxazol-2-amine;2-[4,5-di(propan-2-yl)thiophen-2-yl]-5-methyl-1,3,4-thiadiazole;1-[4,5-di(propan-2-yl)thiophen-2-yl]-4-methyltriazole
CID 157320796
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
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
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-[3,5-Bis(trifluoromethyl)phenyl]-5-methyl-1,3-oxazole;2-(4-fluorophenyl)-4-methyl-1,3-oxazole;2-(4-fluorophenyl)-5-methyl-1,3-oxazole;2-(4-fluorophenyl)-4-methyl-1,3-thiazole;2-(4-fluorophenyl)-5-methyl-1,3-thiazole;2-methyl-5-phenyl-1,2,4-oxadiazol-2-ium;4-methyl-2-phenyl-1,3-oxazole;5-methyl-2-phenyl-1,3-oxazole;5-methyl-2-(4-phenylphenyl)-1,3-oxazole;4-methyl-2-phenyl-1,3-thiazole;5-methyl-2-phenyl-1,3-thiazole;4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazole;5-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazole;4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole;5-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole;2-phenyl-1,3,4-oxadiazole;2-phenyl-1,3,4-thiadiazole;1,1,4,4-tetramethyl-2,3-dihydronaphthalene
CID 158057893
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
5-Tert-butyl-3-cyclopropyl-1,2-oxazole;2-tert-butyl-4-ethylfuran;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methylfuran;2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;4-tert-butyl-1-methylpyrazole;5-tert-butyl-2-methyl-1,3-thiazole;2-tert-butyl-4-methylthiophene;2-tert-butyl-4-(2,2,2-trifluoroethyl)-1,3-oxazole;5-tert-butyl-3-(2,2,2-trifluoroethyl)-1,2-oxazole;4-tert-butyl-1-(2,2,2-trifluoroethyl)pyrazole;2-cyclopropyl-5-propan-2-yl-1,3-oxazole;methane;5-propan-2-yl-1,3-oxazole
CID 158177441
5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-2-cyclopropyl-1,3-thiazole;2-tert-butyl-4-ethylfuran;2-tert-butyl-4-ethyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-1-methylpyrazole;1-(5-tert-butyl-1,2-oxazol-3-yl)-N,N-dimethylethenamine;4-[1-(5-tert-butyl-1,2-oxazol-3-yl)ethenyl]morpholine;3,5-ditert-butyl-1,2-oxazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;1-fluoro-3-propan-2-ylbenzene;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;1-methyl-4-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-propylfuran;5-propan-2-yl-3-(2,2,2-trifluoroethyl)-1,2,4-oxadiazole
CID 158686382
5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(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;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;3-ethyl-5-propan-2-yl-1,2-oxazole;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;1-propan-2-ylpyrazole
CID 158711469
5-Tert-butyl-3-(difluoromethyl)-1,2,4-oxadiazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1-(2,2-difluoropropyl)pyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;2-tert-butyl-4-methylfuran;2-tert-butyl-5-methylfuran;2-tert-butyl-4-methyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;5-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-2-methyltriazole;(5-tert-butyl-1,2-oxazol-3-yl)-morpholin-4-ylmethanone;2-methyl-4-propan-2-ylpyridine;5-propan-2-yl-1,3-oxazole
CID 158886857
5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-2-cyclopropyl-1,3-thiazole;2-tert-butyl-4-ethylfuran;2-tert-butyl-4-ethyl-1,3-oxazole;2-tert-butyl-5-methyl-1,3-oxazole;3-tert-butyl-1-methylpyrazole;4-tert-butyl-1-methylpyrazole;4-tert-butyl-2-methyltriazole;1-(5-tert-butyl-1,2-oxazol-3-yl)-N,N-dimethylethenamine;4-[1-(5-tert-butyl-1,2-oxazol-3-yl)ethenyl]morpholine;5-tert-butyl-3-propyl-1,2-oxazole;2-tert-butyl-4-(2,2,2-trifluoroethyl)-1,3-oxazole;3,5-ditert-butyl-1,2-oxazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;2-methyl-5-propan-2-yl-3H-pyrrole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole
CID 158924670

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene?
The IUPAC name of 4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene (CID 159263106) is 4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene.
What is the SMILES notation for 4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene?
The canonical SMILES for 4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene is CC(C)(C)c1cccc(C(C)(C)C)n1.CC(C)c1cc(C(C)(C)C)co1.CC(C)c1cc(C(C)(C)C)cs1.CC(C)c1ccc(C(C)C)o1.CC(C)c1ccc(C(C)C)s1.CC(C)c1cnc(C(C)C)o1.CC(C)c1cnc(C(C)C)s1.CC(C)c1nc(C(C)(C)C)co1.CC(C)c1nc(C(C)(C)C)cs1.CC(C)c1nnc(C(C)C)o1.CC(C)c1noc(C(C)C)n1.
What is the InChIKey of 4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene?
The InChIKey is KWTIYIYJWCTRPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N.C11H18O.C11H18S.C10H17NO.C10H17NS.C10H16O.C10H16S.C9H15NO.C9H15NS.2C8H14N2O/c1-12(2,3)10-8-7-9-11(14-10)13(4,5)6;2*1-8(2)10-6-9(7-12-10)11(3,4)5;2*1-7(2)9-11-8(6-12-9)10(3,4)5;2*1-7(2)9-5-6-10(11-9)8(3)4;2*1-6(2)8-5-10-9(11-8)7(3)4;1-5(2)7-9-10-8(11-7)6(3)4;1-5(2)7-9-8(6(3)4)11-10-7/h7-9H,1-6H3;2*6-8H,1-5H3;2*6-7H,1-5H3;2*5-8H,1-4H3;2*5-7H,1-4H3;2*5-6H,1-4H3.
What are the key properties of 4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene?
4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene has a molecular weight of 1841.97 g/mol, XLogP of 36.67, 16 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-2-propan-2-ylfuran;4-tert-butyl-2-propan-2-yl-1,3-oxazole;4-tert-butyl-2-propan-2-yl-1,3-thiazole;4-tert-butyl-2-propan-2-ylthiophene;2,6-ditert-butylpyridine;2,5-di(propan-2-yl)furan;2,5-di(propan-2-yl)-1,3,4-oxadiazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;2,5-di(propan-2-yl)-1,3-oxazole;2,5-di(propan-2-yl)-1,3-thiazole;2,5-di(propan-2-yl)thiophene is sourced from PubChem (CID 159263106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).