2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole

C136H235F3N24O2S4 — CID 159774368

IUPAC2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole
SMILESC.C.C.C.C.C.C.CC(C)(C)c1ccc(C2CC2)s1.CC(C)(C)c1cncnc1.CC(C)(C)c1cnn(CC(F)(F)F)n1.CC(C)C1=CCC=N1.CC(C)c1ccccc1.CC(C)c1ccn[nH]1.CC(C)c1ccoc1.CC(C)c1noc(C2CC2)n1.CC(C)n1ccnc1.CC(C)n1cnc(CN(C)C)n1.Cc1cc(C)n(C(C)C)c1.Cc1cc(C)n(C(C)C)n1.Cc1cn(C(C)C)nc1C.Cc1csc(C(C)(C)C)n1.Cc1nc(C(C)(C)C)c(C)s1.Cc1nc(C)c(C(C)(C)C)s1
InChIInChI=1S/C11H16S.2C9H15NS.C9H15N.C9H12.C8H12F3N3.C8H16N4.C8H12N2O.C8H12N2.2C8H14N2.C8H13NS.C7H11N.C7H10O.2C6H10N2.7CH4/c1-11(2,3)10-7-6-9(12-10)8-4-5-8;1-6-8(9(3,4)5)10-7(2)11-6;1-6-8(9(3,4)5)11-7(2)10-6;1-7(2)10-6-8(3)5-9(10)4;1-8(2)9-6-4-3-5-7-9;1-7(2,3)6-4-12-14(13-6)5-8(9,10)11;1-7(2)12-6-9-8(10-12)5-11(3)4;1-5(2)7-9-8(11-10-7)6-3-4-6;1-8(2,3)7-4-9-6-10-5-7;1-6(2)10-5-7(3)8(4)9-10;1-6(2)10-8(4)5-7(3)9-10;1-6-5-10-7(9-6)8(2,3)4;1-6(2)7-4-3-5-8-7;1-6(2)7-3-4-8-5-7;1-6(2)8-4-3-7-5-8;1-5(2)6-3-4-7-8-6;;;;;;;/h6-8H,4-5H2,1-3H3;2*1-5H3;5-7H,1-4H3;3-8H,1-2H3;4H,5H2,1-3H3;6-7H,5H2,1-4H3;5-6H,3-4H2,1-2H3;4-6H,1-3H3;2*5-6H,1-4H3;5H,1-4H3;4-6H,3H2,1-2H3;2*3-6H,1-2H3;3-5H,1-2H3,(H,7,8);7*1H4
InChIKeyNGNQUHZDAPEIAQ-UHFFFAOYSA-N
MW2423.80 g/mol
LogP41.20
Rot. Bonds15

About 2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole

2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole (PubChem CID 159774368) has the molecular formula C136H235F3N24O2S4 and a molecular weight of 2423.80 g/mol. Its IUPAC name is 2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole.

Molecular Properties

Compound Name2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole
PubChem CID159774368
Molecular FormulaC136H235F3N24O2S4
Molecular Weight2423.80 g/mol
Exact Mass2421.79
IUPAC Name2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole
SMILESC.C.C.C.C.C.C.CC(C)(C)c1ccc(C2CC2)s1.CC(C)(C)c1cncnc1.CC(C)(C)c1cnn(CC(F)(F)F)n1.CC(C)C1=CCC=N1.CC(C)c1ccccc1.CC(C)c1ccn[nH]1.CC(C)c1ccoc1.CC(C)c1noc(C2CC2)n1.CC(C)n1ccnc1.CC(C)n1cnc(CN(C)C)n1.Cc1cc(C)n(C(C)C)c1.Cc1cc(C)n(C(C)C)n1.Cc1cn(C(C)C)nc1C.Cc1csc(C(C)(C)C)n1.Cc1nc(C(C)(C)C)c(C)s1.Cc1nc(C)c(C(C)(C)C)s1
InChIInChI=1S/C11H16S.2C9H15NS.C9H15N.C9H12.C8H12F3N3.C8H16N4.C8H12N2O.C8H12N2.2C8H14N2.C8H13NS.C7H11N.C7H10O.2C6H10N2.7CH4/c1-11(2,3)10-7-6-9(12-10)8-4-5-8;1-6-8(9(3,4)5)10-7(2)11-6;1-6-8(9(3,4)5)11-7(2)10-6;1-7(2)10-6-8(3)5-9(10)4;1-8(2)9-6-4-3-5-7-9;1-7(2,3)6-4-12-14(13-6)5-8(9,10)11;1-7(2)12-6-9-8(10-12)5-11(3)4;1-5(2)7-9-8(11-10-7)6-3-4-6;1-8(2,3)7-4-9-6-10-5-7;1-6(2)10-5-7(3)8(4)9-10;1-6(2)10-8(4)5-7(3)9-10;1-6-5-10-7(9-6)8(2,3)4;1-6(2)7-4-3-5-8-7;1-6(2)7-3-4-8-5-7;1-6(2)8-4-3-7-5-8;1-5(2)6-3-4-7-8-6;;;;;;;/h6-8H,4-5H2,1-3H3;2*1-5H3;5-7H,1-4H3;3-8H,1-2H3;4H,5H2,1-3H3;6-7H,5H2,1-4H3;5-6H,3-4H2,1-2H3;4-6H,1-3H3;2*5-6H,1-4H3;5H,1-4H3;4-6H,3H2,1-2H3;2*3-6H,1-2H3;3-5H,1-2H3,(H,7,8);7*1H4
InChIKeyNGNQUHZDAPEIAQ-UHFFFAOYSA-N
XLogP41.20
TPSA280.60 Ų
H-Bond Donors1
H-Bond Acceptors29
Rotatable Bonds15
Heavy Atoms169
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002423.80
LogP ≤ 541.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1029

Analyze 2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole with MolForge

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Launch Full Analysis

Related Compounds

2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2-(2,2-difluoropropyl)triazole;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-[(4-tert-butylthiophen-2-yl)methyl]morpholine;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;4-propan-2-yl-1-propylpyrazole;5-propan-2-yl-2H-pyrrole;5-propan-2-yl-3H-pyrrole
CID 157989358
1-benzyl-4-propan-2-ylpyrazole;5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;3-tert-butyl-1-methylpyrazole;3-tert-butyl-1-methylpyrrole;2-tert-butyl-1,3,4-thiadiazole;4-tert-butyl-2H-triazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;1,5-dimethyl-4-propan-2-ylpyrazole;1-ethyl-4-propan-2-ylpyrazole;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;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;(5-propan-2-yl-1,2-oxazol-3-yl)methanol;1-propan-2-ylpyrazole;(5-propan-2-ylthiophen-2-yl)methanol;1-propan-2-yl-1,2,4-triazole
CID 158463660
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-2,3-dimethylfuran;3-tert-butyl-1,5-dimethylpyrazole;3-tert-butyl-4,5-dimethyl-1,2,4-triazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;3-tert-butyl-5-methyl-1H-pyrazole;2-tert-butyl-4-methylpyridine;4-tert-butyl-6-methylpyrimidine;2-tert-butyl-5-methyl-1,3,4-thiadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;4-tert-butyl-2-methyl-1,3-thiazole;4,5-dimethyl-1-propan-2-ylpyrazole;3-(2,2-dimethylpropyl)-5-methyl-1,2-oxazole;3-(2-fluoropropan-2-yl)-5-methyl-1,2-oxazole;5-methyl-3-(2-methylbutan-2-yl)-1,2-oxazole;3-methyl-5-(2-methylpropyl)-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-1-propan-2-ylpyrazole;4-methyl-1-propan-2-yltriazole;5-methyl-3-(trifluoromethyl)-1,2-oxazole;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-5-(trifluoromethyl)-1,3,4-thiadiazole
CID 158832470
1-tert-butylpyrrolidine;cumene;1,1-difluoro-4-methylpentane;2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;2,4-dimethylpent-2-ene;1-fluoro-3-(2-methylpropyl)benzene;1-fluoro-4-propan-2-ylbenzene;2-methylhexane;2-methylpentane;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrrole;2-methyl-5-propan-2-ylthiophene;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;2-methylpropylcyclopropane;propan-2-ylcyclobutane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;1-propan-2-ylcyclopentene;propan-2-ylcyclopropane;2-propan-2-ylfuran;4-propan-2-yl-1H-pyrazole;3-propan-2-yl-1H-pyrrole;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-ylthiophene;1,1,1-trifluoro-4-methylpentane;2,2,3-trimethylbutane;2,2,4-trimethylpentane;2,3,3-trimethylpentane
CID 158853720
2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;3-tert-butylpyridine;4-[(4-tert-butylthiophen-2-yl)methyl]morpholine;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;2-(2,2-difluoropropyl)-4-propan-2-yltriazole;2,4-dimethyl-1-propan-2-ylimidazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;3-propan-2-ylfuran;1-propan-2-ylimidazole;4-propan-2-yl-1-propylpyrazole;4-propan-2-ylpyridine;4-propan-2-yl-2H-pyrrole;5-propan-2-yl-2H-pyrrole
CID 158946007
1-Benzyl-4-propan-2-ylpyrazole;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;3-propan-2-ylpyridine
CID 159443558
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;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-yl-4H-pyrazol-1-ium;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;1-propan-2-ylpyrazole
CID 159575313
2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;2,4-dimethyl-1-propan-2-ylimidazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-2H-pyrrole;5-propan-2-yl-3H-pyrrole
CID 160176146
1-benzyl-4-propan-2-ylpyrazole;5-tert-butyl-3-(1,1-difluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;1,5-dimethyl-4-propan-2-ylpyrazole;3-ethyl-5-propan-2-yl-1,2-oxazole;1-ethyl-4-propan-2-ylpyrazole;2-ethyl-4-propan-2-yltriazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;1-methyl-3-propan-2-ylpyrrole;3-methyl-1-propan-2-ylpyrrole;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;bis(1-propan-2-ylpyrazole);3-propan-2-yl-1H-pyrrole;(5-propan-2-ylthiophen-2-yl)methanol
CID 160710342
2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2-(2,2-difluoropropyl)triazole;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;cumene;2-cyclopropyl-5-propan-2-yl-3H-pyrrole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;3-propan-2-ylfuran;1-propan-2-ylimidazole;4-propan-2-yl-1-propylpyrazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole
CID 161130887
4-tert-butyl-2,5-dimethyl-1,3-thiazole;4-tert-butyl-1-(2-methylpropyl)pyrazole;2-tert-butyl-5-methylthiophene;4-[(4-tert-butylthiophen-2-yl)methyl]morpholine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;2-cyclopropyl-5-propan-2-yl-1,3-oxazole;3-cyclopropyl-1-propan-2-yl-1,2,4-triazole;3,4-dimethyl-1-propan-2-ylpyrazole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;2-ethyl-4-propan-2-yl-1,3-thiazole;5-ethyl-3-propyl-1,2,4-oxadiazole;3-methyl-1-propan-2-ylpyrazole;4-methyl-2-propan-2-ylthiophene;2-[(4-methylpyrazol-1-yl)methyl]pyridine;3-propan-2-ylfuran;4-propan-2-yl-1-propylpyrazole;3-[(4-propan-2-ylpyrazol-1-yl)methyl]pyridine;5-propan-2-yl-3H-pyrrole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene
CID 161459908

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole?
The IUPAC name of 2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole (CID 159774368) is 2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole.
What is the SMILES notation for 2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole?
The canonical SMILES for 2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole is C.C.C.C.C.C.C.CC(C)(C)c1ccc(C2CC2)s1.CC(C)(C)c1cncnc1.CC(C)(C)c1cnn(CC(F)(F)F)n1.CC(C)C1=CCC=N1.CC(C)c1ccccc1.CC(C)c1ccn[nH]1.CC(C)c1ccoc1.CC(C)c1noc(C2CC2)n1.CC(C)n1ccnc1.CC(C)n1cnc(CN(C)C)n1.Cc1cc(C)n(C(C)C)c1.Cc1cc(C)n(C(C)C)n1.Cc1cn(C(C)C)nc1C.Cc1csc(C(C)(C)C)n1.Cc1nc(C(C)(C)C)c(C)s1.Cc1nc(C)c(C(C)(C)C)s1.
What is the InChIKey of 2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole?
The InChIKey is NGNQUHZDAPEIAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16S.2C9H15NS.C9H15N.C9H12.C8H12F3N3.C8H16N4.C8H12N2O.C8H12N2.2C8H14N2.C8H13NS.C7H11N.C7H10O.2C6H10N2.7CH4/c1-11(2,3)10-7-6-9(12-10)8-4-5-8;1-6-8(9(3,4)5)10-7(2)11-6;1-6-8(9(3,4)5)11-7(2)10-6;1-7(2)10-6-8(3)5-9(10)4;1-8(2)9-6-4-3-5-7-9;1-7(2,3)6-4-12-14(13-6)5-8(9,10)11;1-7(2)12-6-9-8(10-12)5-11(3)4;1-5(2)7-9-8(11-10-7)6-3-4-6;1-8(2,3)7-4-9-6-10-5-7;1-6(2)10-5-7(3)8(4)9-10;1-6(2)10-8(4)5-7(3)9-10;1-6-5-10-7(9-6)8(2,3)4;1-6(2)7-4-3-5-8-7;1-6(2)7-3-4-8-5-7;1-6(2)8-4-3-7-5-8;1-5(2)6-3-4-7-8-6;;;;;;;/h6-8H,4-5H2,1-3H3;2*1-5H3;5-7H,1-4H3;3-8H,1-2H3;4H,5H2,1-3H3;6-7H,5H2,1-4H3;5-6H,3-4H2,1-2H3;4-6H,1-3H3;2*5-6H,1-4H3;5H,1-4H3;4-6H,3H2,1-2H3;2*3-6H,1-2H3;3-5H,1-2H3,(H,7,8);7*1H4.
What are the key properties of 2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole?
2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole has a molecular weight of 2423.80 g/mol, XLogP of 41.20, 15 rotatable bonds, 1 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;5-tert-butyl-2,4-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;5-tert-butylpyrimidine;4-tert-butyl-2-(2,2,2-trifluoroethyl)triazole;cumene;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-1-propan-2-ylpyrrole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;methane;3-propan-2-ylfuran;1-propan-2-ylimidazole;5-propan-2-yl-1H-pyrazole;5-propan-2-yl-3H-pyrrole is sourced from PubChem (CID 159774368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).