tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane

C129H205N31O5S — CID 162279239

IUPACtert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane
SMILESCC(C)(C)OC1CCC1.CC(C)(C)c1cccc2nncn12.CC(C)(C)c1ccccc1.CC(C)(C)c1cccn2ccnc12.CC(C)(C)c1cn[nH]c1.CC(C)(C)c1cnc[nH]1.CC(C)(C)c1cnc[nH]1.CC(C)(C)c1cocn1.CC(C)(C)c1cscn1.CC(C)(C)c1ncc[nH]1.CC(C)(C)c1nccn2ccnc12.CC(C)(C)c1ncco1.CC(C)(C)c1ncn[nH]1.CC(C)(C)c1ncon1.CC(C)(C)c1nnco1.CC(C)(C)n1cccn1.CC(C)(C)n1ccnn1
InChIInChI=1S/C11H14N2.2C10H13N3.C10H14.C8H16O.5C7H12N2.2C7H11NO.C7H11NS.2C6H11N3.2C6H10N2O/c1-11(2,3)9-5-4-7-13-8-6-12-10(9)13;1-10(2,3)8-9-12-5-7-13(9)6-4-11-8;1-10(2,3)8-5-4-6-9-12-11-7-13(8)9;1-10(2,3)9-7-5-4-6-8-9;1-8(2,3)9-7-5-4-6-7;2*1-7(2,3)6-4-8-5-9-6;1-7(2,3)6-4-8-9-5-6;1-7(2,3)6-8-4-5-9-6;1-7(2,3)9-6-4-5-8-9;1-7(2,3)6-4-9-5-8-6;1-7(2,3)6-8-4-5-9-6;1-7(2,3)6-4-9-5-8-6;1-6(2,3)5-7-4-8-9-5;1-6(2,3)9-5-4-7-8-9;1-6(2,3)5-8-7-4-9-5;1-6(2,3)5-7-4-9-8-5/h4-8H,1-3H3;2*4-7H,1-3H3;4-8H,1-3H3;7H,4-6H2,1-3H3;4*4-5H,1-3H3,(H,8,9);4-6H,1-3H3;3*4-5H,1-3H3;4H,1-3H3,(H,7,8,9);4-5H,1-3H3;2*4H,1-3H3
InChIKeyPHATWQBUNWZWIL-UHFFFAOYSA-N
MW2302.34 g/mol
LogP31.74
Rot. Bonds1

About tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane

tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane (PubChem CID 162279239) has the molecular formula C129H205N31O5S and a molecular weight of 2302.34 g/mol. Its IUPAC name is tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane.

Molecular Properties

Compound Nametert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane
PubChem CID162279239
Molecular FormulaC129H205N31O5S
Molecular Weight2302.34 g/mol
Exact Mass2300.65
IUPAC Nametert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane
SMILESCC(C)(C)OC1CCC1.CC(C)(C)c1cccc2nncn12.CC(C)(C)c1ccccc1.CC(C)(C)c1cccn2ccnc12.CC(C)(C)c1cn[nH]c1.CC(C)(C)c1cnc[nH]1.CC(C)(C)c1cnc[nH]1.CC(C)(C)c1cocn1.CC(C)(C)c1cscn1.CC(C)(C)c1ncc[nH]1.CC(C)(C)c1nccn2ccnc12.CC(C)(C)c1ncco1.CC(C)(C)c1ncn[nH]1.CC(C)(C)c1ncon1.CC(C)(C)c1nnco1.CC(C)(C)n1cccn1.CC(C)(C)n1ccnn1
InChIInChI=1S/C11H14N2.2C10H13N3.C10H14.C8H16O.5C7H12N2.2C7H11NO.C7H11NS.2C6H11N3.2C6H10N2O/c1-11(2,3)9-5-4-7-13-8-6-12-10(9)13;1-10(2,3)8-9-12-5-7-13(9)6-4-11-8;1-10(2,3)8-5-4-6-9-12-11-7-13(8)9;1-10(2,3)9-7-5-4-6-8-9;1-8(2,3)9-7-5-4-6-7;2*1-7(2,3)6-4-8-5-9-6;1-7(2,3)6-4-8-9-5-6;1-7(2,3)6-8-4-5-9-6;1-7(2,3)9-6-4-5-8-9;1-7(2,3)6-4-9-5-8-6;1-7(2,3)6-8-4-5-9-6;1-7(2,3)6-4-9-5-8-6;1-6(2,3)5-7-4-8-9-5;1-6(2,3)9-5-4-7-8-9;1-6(2,3)5-8-7-4-9-5;1-6(2,3)5-7-4-9-8-5/h4-8H,1-3H3;2*4-7H,1-3H3;4-8H,1-3H3;7H,4-6H2,1-3H3;4*4-5H,1-3H3,(H,8,9);4-6H,1-3H3;3*4-5H,1-3H3;4H,1-3H3,(H,7,8,9);4-5H,1-3H3;2*4H,1-3H3
InChIKeyPHATWQBUNWZWIL-UHFFFAOYSA-N
XLogP31.74
TPSA434.52 Ų
H-Bond Donors5
H-Bond Acceptors32
Rotatable Bonds1
Heavy Atoms166
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002302.34
LogP ≤ 531.74
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1032

Analyze tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane with MolForge

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Launch Full Analysis

Related Compounds

2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;3-propan-2-ylpyridazine;bis(4-propan-2-ylpyridazine);2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole
CID 157105515
tert-butylbenzene;5-tert-butyl-1H-imidazole;2-tert-butyl-1,3-oxazole;3-tert-butyl-1,2-oxazole;2-tert-butylpyrazine;3-tert-butyl-4H-pyrazole;5-tert-butyl-1H-pyrazole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;2-tert-butyl-3H-pyrrole;5-tert-butyl-2H-tetrazole;2-tert-butyl-1,3-thiazole;4-tert-butyl-1,3-thiazole;5-tert-butyl-1,3-thiazole
CID 157121562
tert-butyl 3-tert-butylpiperidine-1-carboxylate;tert-butylcyclohexane;2-tert-butylcyclopenta-1,3-diene;2-tert-butyl-1H-imidazole;4-tert-butyl-2-methylidenepyrrolidine;2-tert-butyl-1-methylimidazole;2-tert-butyl-5-methyl-1H-imidazole;5-tert-butyl-4-methyl-1,3-oxazole;tert-butyl (3S)-3-methylpiperidine-1-carboxylate;tert-butyl (3R)-3-methylpiperidine-1-carboxylate;3-tert-butyl-1-methylpyrazole;bis(3-tert-butyl-4-methylpyridine);5-tert-butyl-2-methylpyrimidin-4-amine;bis(5-tert-butyl-2-methylpyrimidine);3-tert-butyl-5-methyl-1H-1,2,4-triazole;5-tert-butyl-1,2-oxazole;2-tert-butyloxolane;3-tert-butyloxolane;2-tert-butylpyrazine;5-tert-butylpyrimidine;4-tert-butyl-2H-pyrrole;4-tert-butyl-1,3-thiazol-2-amine;2-tert-butylthiophene;ethane;(2R)-2-methyloxolane;(2S)-2-methyloxolane;(3R)-3-methyloxolane;(3S)-3-methyloxolane
CID 157162034
5-methyl-1H-imidazole;4-methylisoquinoline;5-methylisoquinoline;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);4-methylquinoline;4-methyl-1,3-thiazole;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole
CID 157174574
2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 157175362
3,5-dimethylpyridin-2-amine;4,5-dimethylpyridin-2-amine;N,5-dimethylpyridin-2-amine;4,5-dimethyl-1,3-thiazol-2-amine;N,5-dimethyl-1,3-thiazol-2-amine;5-methyl-1H-imidazol-2-amine;4-methyl-1H-indazole;5-methyl-1H-indazole;3-methyl-1,2,4-oxadiazol-5-amine;4-methyl-1,3-oxazol-2-amine;5-methyl-1,3-oxazol-2-amine;5-methyl-1H-pyrazol-3-amine;5-methyl-1H-pyrazolo[5,4-b]pyridine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;N-(5-methyl-2-pyridinyl)acetamide;2-methylpyrimidin-5-amine;5-methylpyrimidin-2-amine;4-methyl-1H-pyrrolo[2,3-b]pyridine;6-methyl-1H-pyrrolo[2,3-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;5-methyl-1H-pyrrolo[2,3-c]pyridine;4-methyl-1,3-thiazol-2-amine;5-methyl-1,3-thiazol-2-amine;N,N,5-trimethyl-1,3-thiazol-2-amine
CID 157196924
5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1H-pyrazole;2-propan-2-ylpyridine
CID 157229571
2,5-dimethyl-1,3-thiazole;4,5-dimethyl-2H-triazole;3-methylimidazo[1,5-a]pyridine;2-methyl-1H-imidazole;1-methylindazole;2-methyl-1,3,4-oxadiazole;5-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;5-methyl-1,3-oxazole;4-methyl-1H-pyrazole;2-methyl-1,3,4-thiadiazole;5-methyl-1,2,4-thiadiazole;5-methyl-1,3-thiazole;4-methyl-2H-triazole;5-methyl-1H-1,2,4-triazole
CID 157547572
benzene;2-tert-butyl-3,4-dihydro-2H-pyran;2-tert-butyl-1,3,4-oxadiazole;2-tert-butyl-1,3-oxazole;5-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;5-tert-butyl-1H-pyrazole;bis(1-tert-butylpyrrole);bis(2-tert-butyl-1H-pyrrole);2-tert-butyl-1,3-thiazole;pentakis(2,2-dimethylpropane);methane;2-methylpropane;pyrazine;pyridazine;pyridine;pyrimidine;2H-triazole
CID 157671188
ethane;2-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;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;2-propan-2-ylpyrimidine;5-propan-2-yl-2H-tetrazole;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-1H-1,2,4-triazole
CID 157678284
5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine
CID 157713088
3-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;2-tert-butylpyrimidine;5-tert-butylpyrimidine;2-tert-butyl-1,3-thiazole;5-tert-butyl-1H-1,2,4-triazole;methane
CID 157784780

Frequently Asked Questions

What is the IUPAC name of tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane?
The IUPAC name of tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane (CID 162279239) is tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane.
What is the SMILES notation for tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane?
The canonical SMILES for tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane is CC(C)(C)OC1CCC1.CC(C)(C)c1cccc2nncn12.CC(C)(C)c1ccccc1.CC(C)(C)c1cccn2ccnc12.CC(C)(C)c1cn[nH]c1.CC(C)(C)c1cnc[nH]1.CC(C)(C)c1cnc[nH]1.CC(C)(C)c1cocn1.CC(C)(C)c1cscn1.CC(C)(C)c1ncc[nH]1.CC(C)(C)c1nccn2ccnc12.CC(C)(C)c1ncco1.CC(C)(C)c1ncn[nH]1.CC(C)(C)c1ncon1.CC(C)(C)c1nnco1.CC(C)(C)n1cccn1.CC(C)(C)n1ccnn1.
What is the InChIKey of tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane?
The InChIKey is PHATWQBUNWZWIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2.2C10H13N3.C10H14.C8H16O.5C7H12N2.2C7H11NO.C7H11NS.2C6H11N3.2C6H10N2O/c1-11(2,3)9-5-4-7-13-8-6-12-10(9)13;1-10(2,3)8-9-12-5-7-13(9)6-4-11-8;1-10(2,3)8-5-4-6-9-12-11-7-13(8)9;1-10(2,3)9-7-5-4-6-8-9;1-8(2,3)9-7-5-4-6-7;2*1-7(2,3)6-4-8-5-9-6;1-7(2,3)6-4-8-9-5-6;1-7(2,3)6-8-4-5-9-6;1-7(2,3)9-6-4-5-8-9;1-7(2,3)6-4-9-5-8-6;1-7(2,3)6-8-4-5-9-6;1-7(2,3)6-4-9-5-8-6;1-6(2,3)5-7-4-8-9-5;1-6(2,3)9-5-4-7-8-9;1-6(2,3)5-8-7-4-9-5;1-6(2,3)5-7-4-9-8-5/h4-8H,1-3H3;2*4-7H,1-3H3;4-8H,1-3H3;7H,4-6H2,1-3H3;4*4-5H,1-3H3,(H,8,9);4-6H,1-3H3;3*4-5H,1-3H3;4H,1-3H3,(H,7,8,9);4-5H,1-3H3;2*4H,1-3H3.
What are the key properties of tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane?
tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane has a molecular weight of 2302.34 g/mol, XLogP of 31.74, 1 rotatable bonds, 5 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butylbenzene;8-tert-butylimidazo[1,2-a]pyrazine;8-tert-butylimidazo[1,2-a]pyridine;2-tert-butyl-1H-imidazole;bis(5-tert-butyl-1H-imidazole);2-tert-butyl-1,3,4-oxadiazole;3-tert-butyl-1,2,4-oxadiazole;2-tert-butyl-1,3-oxazole;4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;4-tert-butyl-1H-pyrazole;4-tert-butyl-1,3-thiazole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;5-tert-butyl-[1,2,4]triazolo[4,3-a]pyridine;(2-methylpropan-2-yl)oxycyclobutane is sourced from PubChem (CID 162279239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).