tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine

C219H440N30O2S4 — CID 158256899

IUPACtert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine
SMILESC.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)(C)C1CCCC1.CC(C)(C)C1CCCCC1.CC(C)(C)N1CCCC1.CC(C)(C)N1CCCC2=C1CN=C2.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCNCC1.CC(C)(C)N1CCOCC1.CC(C)(C)N1CCSCC1.CC(C)(C)c1ccccn1.CC(C)(C)c1cccnn1.CC(C)(C)c1ccn[nH]1.CC(C)(C)c1cn[nH]c1.CC(C)(C)c1cncnc1.CC(C)(C)c1cnoc1.CC(C)(C)c1cnsc1.CC(C)(C)c1csnn1.CC(C)(C)c1nccs1.CC(C)(C)n1cccn1.CC(C)(C)n1nccn1.Cc1cccc2c1CN=C2.Cc1cccnc1.Cc1ccncc1
InChIInChI=1S/C11H18N2.C10H20.C9H9N.C9H19N.C9H13N.C9H18.C8H12N2.C8H18N2.C8H12N2.C8H17NO.C8H17NS.C8H17N.3C7H12N2.C7H11NO.2C7H11NS.C6H11N3.C6H10N2S.2C6H7N.23C2H6.2CH4/c1-11(2,3)13-6-4-5-9-7-12-8-10(9)13;1-10(2,3)9-7-5-4-6-8-9;1-7-3-2-4-8-5-10-6-9(7)8;1-9(2,3)10-7-5-4-6-8-10;1-9(2,3)8-6-4-5-7-10-8;1-9(2,3)8-6-4-5-7-8;1-8(2,3)7-4-9-6-10-5-7;1-8(2,3)10-6-4-9-5-7-10;1-8(2,3)7-5-4-6-9-10-7;2*1-8(2,3)9-4-6-10-7-5-9;1-8(2,3)9-6-4-5-7-9;1-7(2,3)6-4-8-9-5-6;1-7(2,3)9-6-4-5-8-9;1-7(2,3)6-4-5-8-9-6;2*1-7(2,3)6-4-8-9-5-6;1-7(2,3)6-8-4-5-9-6;1-6(2,3)9-7-4-5-8-9;1-6(2,3)5-4-9-8-7-5;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;23*1-2;;/h7H,4-6,8H2,1-3H3;9H,4-8H2,1-3H3;2-5H,6H2,1H3;4-8H2,1-3H3;4-7H,1-3H3;8H,4-7H2,1-3H3;4-6H,1-3H3;9H,4-7H2,1-3H3;4-6H,1-3H3;2*4-7H2,1-3H3;4-7H2,1-3H3;4-5H,1-3H3,(H,8,9);4-6H,1-3H3;4-5H,1-3H3,(H,8,9);4*4-5H,1-3H3;4H,1-3H3;2*2-5H,1H3;23*1-2H3;2*1H4
InChIKeyGHJWMFILVYNPAL-UHFFFAOYSA-N
MW3654.40 g/mol
LogP67.13
Rot. Bonds

About tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine

tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine (PubChem CID 158256899) has the molecular formula C219H440N30O2S4 and a molecular weight of 3654.40 g/mol. Its IUPAC name is tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine.

Molecular Properties

Compound Nametert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine
PubChem CID158256899
Molecular FormulaC219H440N30O2S4
Molecular Weight3654.40 g/mol
Exact Mass3651.41
IUPAC Nametert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine
SMILESC.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)(C)C1CCCC1.CC(C)(C)C1CCCCC1.CC(C)(C)N1CCCC1.CC(C)(C)N1CCCC2=C1CN=C2.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCNCC1.CC(C)(C)N1CCOCC1.CC(C)(C)N1CCSCC1.CC(C)(C)c1ccccn1.CC(C)(C)c1cccnn1.CC(C)(C)c1ccn[nH]1.CC(C)(C)c1cn[nH]c1.CC(C)(C)c1cncnc1.CC(C)(C)c1cnoc1.CC(C)(C)c1cnsc1.CC(C)(C)c1csnn1.CC(C)(C)c1nccs1.CC(C)(C)n1cccn1.CC(C)(C)n1nccn1.Cc1cccc2c1CN=C2.Cc1cccnc1.Cc1ccncc1
InChIInChI=1S/C11H18N2.C10H20.C9H9N.C9H19N.C9H13N.C9H18.C8H12N2.C8H18N2.C8H12N2.C8H17NO.C8H17NS.C8H17N.3C7H12N2.C7H11NO.2C7H11NS.C6H11N3.C6H10N2S.2C6H7N.23C2H6.2CH4/c1-11(2,3)13-6-4-5-9-7-12-8-10(9)13;1-10(2,3)9-7-5-4-6-8-9;1-7-3-2-4-8-5-10-6-9(7)8;1-9(2,3)10-7-5-4-6-8-10;1-9(2,3)8-6-4-5-7-10-8;1-9(2,3)8-6-4-5-7-8;1-8(2,3)7-4-9-6-10-5-7;1-8(2,3)10-6-4-9-5-7-10;1-8(2,3)7-5-4-6-9-10-7;2*1-8(2,3)9-4-6-10-7-5-9;1-8(2,3)9-6-4-5-7-9;1-7(2,3)6-4-8-9-5-6;1-7(2,3)9-6-4-5-8-9;1-7(2,3)6-4-5-8-9-6;2*1-7(2,3)6-4-8-9-5-6;1-7(2,3)6-8-4-5-9-6;1-6(2,3)9-7-4-5-8-9;1-6(2,3)5-4-9-8-7-5;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;23*1-2;;/h7H,4-6,8H2,1-3H3;9H,4-8H2,1-3H3;2-5H,6H2,1H3;4-8H2,1-3H3;4-7H,1-3H3;8H,4-7H2,1-3H3;4-6H,1-3H3;9H,4-7H2,1-3H3;4-6H,1-3H3;2*4-7H2,1-3H3;4-7H2,1-3H3;4-5H,1-3H3,(H,8,9);4-6H,1-3H3;4-5H,1-3H3,(H,8,9);4*4-5H,1-3H3;4H,1-3H3;2*2-5H,1H3;23*1-2H3;2*1H4
InChIKeyGHJWMFILVYNPAL-UHFFFAOYSA-N
XLogP67.13
TPSA339.13 Ų
H-Bond Donors3
H-Bond Acceptors34
Rotatable Bonds
Heavy Atoms255
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003654.40
LogP ≤ 567.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1034

Analyze tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine with MolForge

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Launch Full Analysis

Related Compounds

tert-butylbenzene;2-tert-butyl-1H-benzimidazole;2-tert-butyl-1,3-benzothiazole;2-tert-butyl-1,3-benzoxazole;3-tert-butyl-1,2-benzoxazole;2-tert-butyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine;2-tert-butyl-6,7-dihydro-4H-pyrano[3,4-d][1,3]thiazole;2-tert-butyl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;2-tert-butylfuran;2-tert-butylimidazo[1,2-a]pyridine;2-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-1H-imidazo[4,5-b]pyridine;bis(5-tert-butyl-1H-imidazole);4-tert-butyloxane;3-tert-butyl-1,2-oxazole;4-tert-butyl-1,2-oxazole;5-tert-butyl-1,2-oxazole;3-tert-butyloxolane;2-tert-butylpyrazine;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;bis(2-tert-butylpyrazolo[1,5-a]pyridine);3-tert-butylpyridazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;5-tert-butylpyrimidine;4-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butylthiophene
CID 158043073
tris(tert-butylcyclohexane);1-tert-butyl-3-methylidenepiperidine;4-tert-butylmorpholine;2-tert-butyloxane;3-tert-butyloxane;1-tert-butylpiperazine;1-tert-butylpiperazin-2-one;1-tert-butylpiperidine;3-tert-butylpiperidine;5-tert-butylpiperidin-3-one;6-tert-butylpiperidin-3-one;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;methane
CID 158137940
tert-butylbenzene;7-tert-butyl-1,2-benzoxazole;3-tert-butyl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;2-tert-butyl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole;1-tert-butyl-5,6-dihydro-4H-pyrrolo[3,4-d]pyrazole;5-tert-butylimidazo[1,2-a]pyridine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);7-tert-butyl-1H-indazole;4-tert-butylmorpholine;2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;3-tert-butyl-1,2-oxazole;4-tert-butyl-1,2-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpiperazine;4-tert-butylpiperidine;2-tert-butylpyrazine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;1-tert-butyltetrazole;2-tert-butyltetrazole;5-tert-butyl-2H-tetrazole;2-tert-butyl-1,3,4-thiadiazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;1-tert-butyl-1,2,4-triazole;2-tert-butyltriazole;4-tert-butyl-2H-triazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[1,5-a]pyridine
CID 162279236
tert-butylcyclohexane;5-tert-butyl-1-methylpyrazole;3-tert-butyloxane;4-tert-butyloxane;3-tert-butyl-1,2-oxazole;3-tert-butyloxolane;4-tert-butylpiperidine;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyrrolidine
CID 158122769
tert-butylbenzene;2-tert-butyl-1,3-benzothiazole;2-tert-butyl-1,3-benzoxazole;bis(1-tert-butylcyclopenta-1,3-diene);tert-butylcyclopentane;3-tert-butylfuran;2-tert-butylimidazo[1,2-a]pyridine;2-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-1H-imidazole;4-tert-butyloxane;3-tert-butyl-1,2-oxazole;5-tert-butyl-1,2-oxazole;2-tert-butylpyrazine;bis(2-tert-butylpyrazolo[1,5-a]pyridine);3-tert-butylpyridazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;5-tert-butylpyrimidine;4-tert-butyl-2H-pyrrole;5-tert-butyl-2H-pyrrole;5-tert-butyl-3H-pyrrole;2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;4-tert-butyl-1,3-thiazole;3-tert-butylthiophene
CID 165104121
tert-butyl 2-tert-butylpyrrole-1-carboxylate;1-tert-butyl-4,4-difluoropiperidine;2-tert-butyl-2,4-dimethyl-1,3-dioxolane;4-tert-butyl-2,6-dimethylmorpholine;4-tert-butyl-3,5-dimethyl-1,2-oxazole;3-tert-butyl-2-fluoropyridine;2-tert-butylfuran;2-tert-butyl-5-methyl-1,3,4-oxadiazole;4-tert-butyl-4-methyloxane;5-tert-butyl-4-methyl-1,3-oxazole;5-tert-butyl-1-methyltetrazole;4-tert-butyloxane;1-tert-butylpiperazine;1-tert-butylpiperidine;5-tert-butylpyrimidine;2-tert-butyl-1H-pyrrole;1-tert-butylpyrrolidine;4-tert-butylthiadiazole;4-tert-butyl-1,4-thiazinane 1,1-dioxide;4-tert-butylthiomorpholine;2-tert-butyl-2,4,5-trimethyl-1,3-dioxolane;methane;methyl 2,2,3,3-tetramethylbutanoate;2-(2,3,3-trimethylbutan-2-yl)-1,3-oxazole;4-(2,3,3-trimethylbutan-2-yl)-1,3-oxazole;5-(2,3,3-trimethylbutan-2-yl)-1,3-oxazole
CID 157420589
tert-butylbenzene;2-tert-butyl-1,3-benzothiazole;2-tert-butyl-1,3-benzoxazole;tert-butylcyclopentane;2-tert-butyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine;2-tert-butyl-6,7-dihydro-4H-pyrano[3,4-d][1,3]thiazole;2-tert-butyl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;2-tert-butylfuran;3-tert-butylfuran;2-tert-butylimidazo[1,2-a]pyridine;2-tert-butylimidazo[1,2-b]pyridazine;2-tert-butyl-1H-imidazole;4-tert-butyloxane;3-tert-butyl-1,2-oxazole;5-tert-butyl-1,2-oxazole;2-tert-butylpyrazine;2-tert-butylpyrazolo[1,5-a]pyridine;3-tert-butylpyridazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;5-tert-butylpyrimidine;4-tert-butyl-2H-pyrrole;5-tert-butyl-2H-pyrrole;5-tert-butyl-3H-pyrrole;4-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butylthiophene;2-methylpyrazolo[1,5-a]pyridine
CID 157320372
tert-butyl 2-tert-butylpyrrole-1-carboxylate;1-tert-butyl-4,4-difluoropiperidine;2-tert-butyl-2,4-dimethyl-1,3-dioxolane;4-tert-butyl-2,6-dimethylmorpholine;4-tert-butyl-3,5-dimethyl-1,2-oxazole;3-tert-butyl-2-fluoropyridine;2-tert-butylfuran;2-tert-butyl-2-methyl-1,3-dioxolane;2-tert-butyl-5-methyl-1,3,4-oxadiazole;4-tert-butyl-4-methyloxane;5-tert-butyl-4-methyl-1,3-oxazole;5-tert-butyl-1-methyltetrazole;4-tert-butyloxane;1-tert-butylpiperazine;1-tert-butylpiperidine;5-tert-butylpyrimidine;2-tert-butyl-1H-pyrrole;1-tert-butylpyrrolidine;4-tert-butylthiadiazole;4-tert-butyl-1,4-thiazinane 1,1-dioxide;4-tert-butylthiomorpholine;3-tert-butylthiophene;2-tert-butyl-2,4,5-trimethyl-1,3-dioxolane;methyl 2,2,3,3-tetramethylbutanoate;2-(2,3,3-trimethylbutan-2-yl)-1,3-oxazole;4-(2,3,3-trimethylbutan-2-yl)-1,3-oxazole;5-(2,3,3-trimethylbutan-2-yl)-1,3-oxazole
CID 159164060
tert-butyl 2-tert-butylpyrrole-1-carboxylate;1-tert-butyl-4,4-difluoropiperidine;2-tert-butyl-2,4-dimethyl-1,3-dioxolane;4-tert-butyl-2,6-dimethylmorpholine;4-tert-butyl-3,5-dimethyl-1,2-oxazole;3-tert-butyl-2-fluoropyridine;2-tert-butylfuran;2-tert-butyl-2-methyl-1,3-dioxolane;2-tert-butyl-5-methyl-1,3,4-oxadiazole;4-tert-butyl-4-methyloxane;5-tert-butyl-4-methyl-1,3-oxazole;5-tert-butyl-1-methyltetrazole;4-tert-butyloxane;1-tert-butylpiperazine;1-tert-butylpiperidine;5-tert-butylpyrimidine;2-tert-butyl-1H-pyrrole;1-tert-butylpyrrolidine;4-tert-butylthiadiazole;4-tert-butyl-1,4-thiazinane 1,1-dioxide;4-tert-butylthiomorpholine;3-tert-butylthiophene;2-tert-butyl-2,4,5-trimethyl-1,3-dioxolane;methane;methyl 2,2,3,3-tetramethylbutanoate;2-(2,3,3-trimethylbutan-2-yl)-1,3-oxazole;4-(2,3,3-trimethylbutan-2-yl)-1,3-oxazole;5-(2,3,3-trimethylbutan-2-yl)-1,3-oxazole
CID 161257224
3-tert-butyl-3-azabicyclo[3.2.1]octane;1-tert-butylazetidine;tert-butylcyclohexane;5-tert-butyl-2,3-dihydro-1H-indole;2-tert-butylfuran;5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;3-tert-butyloxolane;1-tert-butylpiperazine;1-tert-butylpiperidine;5-tert-butyl-3H-pyrrole;cumene;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;7-propan-2-yl-1-benzofuran;4-propan-2-yl-1H-indazole;7-propan-2-yl-1H-indene;4-propan-2-yl-1H-indole;6-propan-2-yl-1H-indole;2-propan-2-ylpyrazine;4-propan-2-yl-1H-pyrazole;bis(5-propan-2-yl-1H-pyrazole);2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;3-propan-2-yl-1H-pyridin-2-one;1-propan-2-ylpyrrolidine;3-propan-2-ylpyrrolidine;5-propan-2-ylquinoline;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;bis(2-propan-2-ylthiophene);3-propan-2-ylthiophene
CID 160672955
2-tert-butylpyrazine;3-tert-butylpyridazine;2-tert-butyl-1,3-thiazole
CID 157287344
1-tert-butylimidazole;5-tert-butyl-1-methylimidazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole
CID 159269954

Frequently Asked Questions

What is the IUPAC name of tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine?
The IUPAC name of tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine (CID 158256899) is tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine.
What is the SMILES notation for tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine?
The canonical SMILES for tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine is C.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)(C)C1CCCC1.CC(C)(C)C1CCCCC1.CC(C)(C)N1CCCC1.CC(C)(C)N1CCCC2=C1CN=C2.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCNCC1.CC(C)(C)N1CCOCC1.CC(C)(C)N1CCSCC1.CC(C)(C)c1ccccn1.CC(C)(C)c1cccnn1.CC(C)(C)c1ccn[nH]1.CC(C)(C)c1cn[nH]c1.CC(C)(C)c1cncnc1.CC(C)(C)c1cnoc1.CC(C)(C)c1cnsc1.CC(C)(C)c1csnn1.CC(C)(C)c1nccs1.CC(C)(C)n1cccn1.CC(C)(C)n1nccn1.Cc1cccc2c1CN=C2.Cc1cccnc1.Cc1ccncc1.
What is the InChIKey of tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine?
The InChIKey is GHJWMFILVYNPAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2.C10H20.C9H9N.C9H19N.C9H13N.C9H18.C8H12N2.C8H18N2.C8H12N2.C8H17NO.C8H17NS.C8H17N.3C7H12N2.C7H11NO.2C7H11NS.C6H11N3.C6H10N2S.2C6H7N.23C2H6.2CH4/c1-11(2,3)13-6-4-5-9-7-12-8-10(9)13;1-10(2,3)9-7-5-4-6-8-9;1-7-3-2-4-8-5-10-6-9(7)8;1-9(2,3)10-7-5-4-6-8-10;1-9(2,3)8-6-4-5-7-10-8;1-9(2,3)8-6-4-5-7-8;1-8(2,3)7-4-9-6-10-5-7;1-8(2,3)10-6-4-9-5-7-10;1-8(2,3)7-5-4-6-9-10-7;2*1-8(2,3)9-4-6-10-7-5-9;1-8(2,3)9-6-4-5-7-9;1-7(2,3)6-4-8-9-5-6;1-7(2,3)9-6-4-5-8-9;1-7(2,3)6-4-5-8-9-6;2*1-7(2,3)6-4-8-9-5-6;1-7(2,3)6-8-4-5-9-6;1-6(2,3)9-7-4-5-8-9;1-6(2,3)5-4-9-8-7-5;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;23*1-2;;/h7H,4-6,8H2,1-3H3;9H,4-8H2,1-3H3;2-5H,6H2,1H3;4-8H2,1-3H3;4-7H,1-3H3;8H,4-7H2,1-3H3;4-6H,1-3H3;9H,4-7H2,1-3H3;4-6H,1-3H3;2*4-7H2,1-3H3;4-7H2,1-3H3;4-5H,1-3H3,(H,8,9);4-6H,1-3H3;4-5H,1-3H3,(H,8,9);4*4-5H,1-3H3;4H,1-3H3;2*2-5H,1H3;23*1-2H3;2*1H4.
What are the key properties of tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine?
tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine has a molecular weight of 3654.40 g/mol, XLogP of 67.13, 0 rotatable bonds, 3 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butylcyclohexane;tert-butylcyclopentane;4-tert-butylmorpholine;4-tert-butyl-1,2-oxazole;1-tert-butylpiperazine;1-tert-butylpiperidine;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;5-tert-butyl-1H-pyrazole;3-tert-butylpyridazine;2-tert-butylpyridine;5-tert-butylpyrimidine;1-tert-butylpyrrolidine;1-tert-butyl-2,3,4,7-tetrahydropyrrolo[3,4-b]pyridine;4-tert-butylthiadiazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,2-thiazole;4-tert-butylthiomorpholine;2-tert-butyltriazole;ethane;methane;7-methyl-1H-isoindole;3-methylpyridine;4-methylpyridine is sourced from PubChem (CID 158256899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).