5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane

C178H274FN27O5S4Si — CID 158795975

IUPAC5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane
SMILESC=S(C)(=O)N(C)c1cccc(C(C)C)n1.CC(=O)Nc1cc(C(C)C)ccn1.CC(C)c1cc(C(C)(C)C)on1.CC(C)c1cc(C(C)(C)C)sn1.CC(C)c1cccc(C(C)(C)C#N)n1.CC(C)c1cccc(C2(C)CC2)n1.CC(C)c1ccn(C(C)(C)C)n1.CC(C)c1ccn(C2CC2)c1.CC(C)c1ccnc(C(C)(C)C)n1.CC(C)c1ccnc(C2(C#N)CC2)c1.CC(C)c1ccnc([Si](C)(C)C)c1.CC(C)c1ccsc1.CC(C)c1ccsc1C(C)(C)F.CC(C)c1nccc(C(C)(C)C)n1.CC(C)c1nccn1C1CC1.CCNC(=O)Nc1cc(C(C)C)ccn1.CCNC(=O)Nc1cccc(C(C)C)n1
InChIInChI=1S/C12H14N2.C12H16N2.C12H17N.2C11H17N3O.C11H18N2OS.2C11H18N2.C11H19NSi.C10H15FS.C10H14N2O.C10H18N2.C10H17NO.C10H17NS.C10H15N.C9H14N2.C7H10S/c1-9(2)10-3-6-14-11(7-10)12(8-13)4-5-12;1-9(2)10-6-5-7-11(14-10)12(3,4)8-13;1-9(2)10-5-4-6-11(13-10)12(3)7-8-12;1-4-12-11(15)14-10-7-9(8(2)3)5-6-13-10;1-4-12-11(15)14-10-7-5-6-9(13-10)8(2)3;1-9(2)10-7-6-8-11(12-10)13(3)15(4,5)14;1-8(2)10-12-7-6-9(13-10)11(3,4)5;1-8(2)9-6-7-12-10(13-9)11(3,4)5;1-9(2)10-6-7-12-11(8-10)13(3,4)5;1-7(2)8-5-6-12-9(8)10(3,4)11;1-7(2)9-4-5-11-10(6-9)12-8(3)13;1-8(2)9-6-7-12(11-9)10(3,4)5;2*1-7(2)8-6-9(12-11-8)10(3,4)5;1-8(2)9-5-6-11(7-9)10-3-4-10;1-7(2)9-10-5-6-11(9)8-3-4-8;1-6(2)7-3-4-8-5-7/h3,6-7,9H,4-5H2,1-2H3;5-7,9H,1-4H3;4-6,9H,7-8H2,1-3H3;2*5-8H,4H2,1-3H3,(H2,12,13,14,15);6-9H,4H2,1-3,5H3;2*6-8H,1-5H3;6-9H,1-5H3;5-7H,1-4H3;4-7H,1-3H3,(H,11,12,13);6-8H,1-5H3;2*6-7H,1-5H3;5-8,10H,3-4H2,1-2H3;5-8H,3-4H2,1-2H3;3-6H,1-2H3
InChIKeyISWFINMPQIARLT-UHFFFAOYSA-N
MW3047.69 g/mol
LogP47.98
Rot. Bonds31

About 5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane

5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane (PubChem CID 158795975) has the molecular formula C178H274FN27O5S4Si and a molecular weight of 3047.69 g/mol. Its IUPAC name is 5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane.

Molecular Properties

Compound Name5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane
PubChem CID158795975
Molecular FormulaC178H274FN27O5S4Si
Molecular Weight3047.69 g/mol
Exact Mass3045.07
IUPAC Name5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane
SMILESC=S(C)(=O)N(C)c1cccc(C(C)C)n1.CC(=O)Nc1cc(C(C)C)ccn1.CC(C)c1cc(C(C)(C)C)on1.CC(C)c1cc(C(C)(C)C)sn1.CC(C)c1cccc(C(C)(C)C#N)n1.CC(C)c1cccc(C2(C)CC2)n1.CC(C)c1ccn(C(C)(C)C)n1.CC(C)c1ccn(C2CC2)c1.CC(C)c1ccnc(C(C)(C)C)n1.CC(C)c1ccnc(C2(C#N)CC2)c1.CC(C)c1ccnc([Si](C)(C)C)c1.CC(C)c1ccsc1.CC(C)c1ccsc1C(C)(C)F.CC(C)c1nccc(C(C)(C)C)n1.CC(C)c1nccn1C1CC1.CCNC(=O)Nc1cc(C(C)C)ccn1.CCNC(=O)Nc1cccc(C(C)C)n1
InChIInChI=1S/C12H14N2.C12H16N2.C12H17N.2C11H17N3O.C11H18N2OS.2C11H18N2.C11H19NSi.C10H15FS.C10H14N2O.C10H18N2.C10H17NO.C10H17NS.C10H15N.C9H14N2.C7H10S/c1-9(2)10-3-6-14-11(7-10)12(8-13)4-5-12;1-9(2)10-6-5-7-11(14-10)12(3,4)8-13;1-9(2)10-5-4-6-11(13-10)12(3)7-8-12;1-4-12-11(15)14-10-7-9(8(2)3)5-6-13-10;1-4-12-11(15)14-10-7-5-6-9(13-10)8(2)3;1-9(2)10-7-6-8-11(12-10)13(3)15(4,5)14;1-8(2)10-12-7-6-9(13-10)11(3,4)5;1-8(2)9-6-7-12-10(13-9)11(3,4)5;1-9(2)10-6-7-12-11(8-10)13(3,4)5;1-7(2)8-5-6-12-9(8)10(3,4)11;1-7(2)9-4-5-11-10(6-9)12-8(3)13;1-8(2)9-6-7-12(11-9)10(3,4)5;2*1-7(2)8-6-9(12-11-8)10(3,4)5;1-8(2)9-5-6-11(7-9)10-3-4-10;1-7(2)9-10-5-6-11(9)8-3-4-8;1-6(2)7-3-4-8-5-7/h3,6-7,9H,4-5H2,1-2H3;5-7,9H,1-4H3;4-6,9H,7-8H2,1-3H3;2*5-8H,4H2,1-3H3,(H2,12,13,14,15);6-9H,4H2,1-3,5H3;2*6-8H,1-5H3;6-9H,1-5H3;5-7H,1-4H3;4-7H,1-3H3,(H,11,12,13);6-8H,1-5H3;2*6-7H,1-5H3;5-8,10H,3-4H2,1-2H3;5-8H,3-4H2,1-2H3;3-6H,1-2H3
InChIKeyISWFINMPQIARLT-UHFFFAOYSA-N
XLogP47.98
TPSA413.42 Ų
H-Bond Donors5
H-Bond Acceptors29
Rotatable Bonds31
Heavy Atoms216
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003047.69
LogP ≤ 547.98
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze 5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane with MolForge

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Launch Full Analysis

Related Compounds

2-cyclopropyl-4-propan-2-ylpyrimidine;1,3-dimethyl-5-propan-2-ylindazole;5-methyl-2-propan-2-yl-4,7-dihydropyrazolo[1,5-a]pyrazin-6-one;1-methyl-4-propan-2-ylimidazole;5-methyl-3-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;6-propan-2-ylimidazo[1,2-a]pyridine;7-propan-2-ylimidazo[1,2-a]pyridine;7-propan-2-ylimidazo[1,2-a]pyrimidine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;6-propan-2-yl-3H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;3-propan-2-yl-6-(trifluoromethyl)pyridazine
CID 159754919
1-tert-butyl-3-propan-2-ylpyrazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;5-(2-fluoropropan-2-yl)-3-propan-2-yl-1,2-oxazole;2-(2-fluoropropan-2-yl)-4-propan-2-ylpyrimidine;4-(2-fluoropropan-2-yl)-2-propan-2-ylpyrimidine;5-(2-fluoropropan-2-yl)-3-propan-2-yl-1,2-thiazole;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-methyl-2-(3-propan-2-ylphenyl)propanenitrile;N-methyl-N-(6-propan-2-yl-2-pyridinyl)methanesulfonamide;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;3-propan-2-ylthiophene;1-propan-2-yl-3-[1-(trifluoromethyl)cyclopropyl]benzene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane
CID 161595316
5-tert-butyl-1-methyl-3-phenylpyrazole;4-tert-butyl-1-methylpiperidine;4-tert-butylmorpholine;4-tert-butylpiperidine;1-(4-tert-butylpiperidin-1-yl)ethanone;1-(3,3-dimethylbutyl)imidazolidin-2-one;4-(3,3-dimethylbutyl)-1-methylimidazole;3-(3,3-dimethylbutyl)-5-methyl-1,2-oxazole;2-(3,3-dimethylbutyl)-1-methylpyrrolidine;2-(3,3-dimethylbutyl)-3-methylthiophene;1-(3,3-dimethylbutyl)piperidine;5-(3,3-dimethylbutyl)pyridin-2-amine;2-(3,3-dimethylbutyl)pyridine;3-(3,3-dimethylbutyl)pyridine;4-(3,3-dimethylbutyl)pyridine;1-(3,3-dimethylbutyl)pyrrolidine;2-(3,3-dimethylbutyl)pyrrolidine;(2S)-2-(2,2-dimethylpropyl)oxolane;(2R)-2-(2,2-dimethylpropyl)oxolane;(3R)-3-(2,2-dimethylpropyl)pyrrolidine;(3S)-3-(2,2-dimethylpropyl)pyrrolidine
CID 157938903
2-tert-butyl-4-ethyl-1,3-thiazole;4-tert-butyl-1-methylimidazole;bis(3-tert-butyl-5-methyl-1,2,4-oxadiazole);3-tert-butyl-4-methyl-1,2-oxazole;tetrakis(3-tert-butyl-5-methyl-1,2-oxazole);5-tert-butyl-3-methyl-1,2-oxazole;3-tert-butyl-1-methylpyrazole;2-tert-butyl-4-methyl-1,3-thiazole;2-tert-butyl-5-methyl-1,3-thiazole;4-tert-butyl-2H-pyrrole;5-tert-butyl-2H-pyrrole;5-tert-butyl-3H-pyrrole;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;4-fluoro-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);5-methyl-2-propan-2-ylpyrimidine;1-methyl-3-propan-2-yl-1,2,4-triazole;2-propan-2-yl-4H-imidazole;bis(2-propan-2-ylpyrazine);3-propan-2-ylpyridazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine
CID 159116040
5-Tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-6-propan-2-ylpyridine;2-tert-butyl-4-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;methane;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;2-methyl-2-(4-propan-2-yl-2-pyridinyl)propanenitrile
CID 159214242
4-tert-butyl-2,6-dimethylpyridine;4-tert-butyl-2-methylpyridine;3,5-dimethyl-4-propan-2-yl-1,2-oxazole;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;3-fluoro-5-propan-2-ylpyridine;1-methyl-4-propan-2-ylimidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;bis(3-methyl-5-propan-2-yl-1,2,4-oxadiazole);5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;2-methyl-5-propan-2-ylpyridine;5-methyl-3-propan-2-yl-2H-pyrrole;2-methyl-5-propan-2-yl-1,3-thiazole;1-methyl-3-propan-2-yl-1,2,4-triazole;2-methyl-4-propan-2-yltriazole;5-propan-2-ylpyridin-2-amine
CID 160622464
4-tert-butyl-3,5-dimethyl-1,2-oxazole;4-tert-butyl-2,6-dimethylpyridine;5-tert-butyl-N,N-dimethylpyrimidin-2-amine;4-tert-butyl-1-methylimidazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;bis(5-tert-butyl-3-methyl-1,2,4-oxadiazole);3-tert-butyl-1-methylpyrazole;bis(5-tert-butyl-2-methylpyrimidine);4-tert-butyl-2-methyltriazole;5-tert-butylpyrimidin-2-amine;5-tert-butylpyrimidine;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;3-fluoro-5-propan-2-ylpyridine;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-2H-pyrrole;2-methyl-5-propan-2-yl-1,3-thiazole;1-methyl-3-propan-2-yl-1,2,4-triazole;5-propan-2-ylpyridin-2-amine
CID 160772628

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane?
The IUPAC name of 5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane (CID 158795975) is 5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane.
What is the SMILES notation for 5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane?
The canonical SMILES for 5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane is C=S(C)(=O)N(C)c1cccc(C(C)C)n1.CC(=O)Nc1cc(C(C)C)ccn1.CC(C)c1cc(C(C)(C)C)on1.CC(C)c1cc(C(C)(C)C)sn1.CC(C)c1cccc(C(C)(C)C#N)n1.CC(C)c1cccc(C2(C)CC2)n1.CC(C)c1ccn(C(C)(C)C)n1.CC(C)c1ccn(C2CC2)c1.CC(C)c1ccnc(C(C)(C)C)n1.CC(C)c1ccnc(C2(C#N)CC2)c1.CC(C)c1ccnc([Si](C)(C)C)c1.CC(C)c1ccsc1.CC(C)c1ccsc1C(C)(C)F.CC(C)c1nccc(C(C)(C)C)n1.CC(C)c1nccn1C1CC1.CCNC(=O)Nc1cc(C(C)C)ccn1.CCNC(=O)Nc1cccc(C(C)C)n1.
What is the InChIKey of 5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane?
The InChIKey is ISWFINMPQIARLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2.C12H16N2.C12H17N.2C11H17N3O.C11H18N2OS.2C11H18N2.C11H19NSi.C10H15FS.C10H14N2O.C10H18N2.C10H17NO.C10H17NS.C10H15N.C9H14N2.C7H10S/c1-9(2)10-3-6-14-11(7-10)12(8-13)4-5-12;1-9(2)10-6-5-7-11(14-10)12(3,4)8-13;1-9(2)10-5-4-6-11(13-10)12(3)7-8-12;1-4-12-11(15)14-10-7-9(8(2)3)5-6-13-10;1-4-12-11(15)14-10-7-5-6-9(13-10)8(2)3;1-9(2)10-7-6-8-11(12-10)13(3)15(4,5)14;1-8(2)10-12-7-6-9(13-10)11(3,4)5;1-8(2)9-6-7-12-10(13-9)11(3,4)5;1-9(2)10-6-7-12-11(8-10)13(3,4)5;1-7(2)8-5-6-12-9(8)10(3,4)11;1-7(2)9-4-5-11-10(6-9)12-8(3)13;1-8(2)9-6-7-12(11-9)10(3,4)5;2*1-7(2)8-6-9(12-11-8)10(3,4)5;1-8(2)9-5-6-11(7-9)10-3-4-10;1-7(2)9-10-5-6-11(9)8-3-4-8;1-6(2)7-3-4-8-5-7/h3,6-7,9H,4-5H2,1-2H3;5-7,9H,1-4H3;4-6,9H,7-8H2,1-3H3;2*5-8H,4H2,1-3H3,(H2,12,13,14,15);6-9H,4H2,1-3,5H3;2*6-8H,1-5H3;6-9H,1-5H3;5-7H,1-4H3;4-7H,1-3H3,(H,11,12,13);6-8H,1-5H3;2*6-7H,1-5H3;5-8,10H,3-4H2,1-2H3;5-8H,3-4H2,1-2H3;3-6H,1-2H3.
What are the key properties of 5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane?
5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane has a molecular weight of 3047.69 g/mol, XLogP of 47.98, 31 rotatable bonds, 5 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-3-propan-2-yl-1,2-oxazole;1-tert-butyl-3-propan-2-ylpyrazole;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;5-tert-butyl-3-propan-2-yl-1,2-thiazole;1-cyclopropyl-2-propan-2-ylimidazole;1-cyclopropyl-3-propan-2-ylpyrrole;1-ethyl-3-(4-propan-2-yl-2-pyridinyl)urea;1-ethyl-3-(6-propan-2-yl-2-pyridinyl)urea;2-(2-fluoropropan-2-yl)-3-propan-2-ylthiophene;2-(1-methylcyclopropyl)-6-propan-2-ylpyridine;N-methyl-N-(methyl-methylidene-oxo-λ6-sulfanyl)-6-propan-2-ylpyridin-2-amine;2-methyl-2-(6-propan-2-yl-2-pyridinyl)propanenitrile;N-(4-propan-2-yl-2-pyridinyl)acetamide;1-(4-propan-2-yl-2-pyridinyl)cyclopropane-1-carbonitrile;3-propan-2-ylthiophene;trimethyl-(4-propan-2-yl-2-pyridinyl)silane is sourced from PubChem (CID 158795975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).