1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole

C158H277N25O3S7 — CID 158478567

IUPAC1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole
SMILESCC(=O)Nc1nc(C(C)(C)C)cs1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCOCC1.CC(C)(C)N1CCc2ccccc21.CC(C)(C)c1cccnc1.CC(C)(C)c1cccs1.CC(C)(C)c1ccncn1.CC(C)(C)c1cnccn1.CC(C)(C)c1cnn(C(C)(C)C)c1.CC(C)(C)c1csc(N)n1.CC(C)(C)c1cscn1.CC1CCN(C(C)(C)C)CC1.CCc1nc(C(C)(C)C)cs1.CN1CCN(C(C)(C)C)CC1.CNc1nc(C(C)(C)C)cs1.COC1CCN(C(C)(C)C)CC1.Cc1nc(C(C)(C)C)cs1.Cn1cc(C(C)(C)C)cn1
InChIInChI=1S/C12H17N.C11H20N2.C10H21NO.C10H21N.C9H14N2OS.C9H20N2.C9H15NS.C9H13N.C9H19N.C8H14N2S.C8H14N2.2C8H12N2.C8H17NO.C8H13NS.C8H12S.C7H12N2S.C7H11NS/c1-12(2,3)13-9-8-10-6-4-5-7-11(10)13;1-10(2,3)9-7-12-13(8-9)11(4,5)6;1-10(2,3)11-7-5-9(12-4)6-8-11;1-9-5-7-11(8-6-9)10(2,3)4;1-6(12)10-8-11-7(5-13-8)9(2,3)4;1-9(2,3)11-7-5-10(4)6-8-11;1-5-8-10-7(6-11-8)9(2,3)4;1-9(2,3)8-5-4-6-10-7-8;1-9(2,3)10-7-5-4-6-8-10;1-8(2,3)6-5-11-7(9-4)10-6;1-8(2,3)7-5-9-10(4)6-7;1-8(2,3)7-6-9-4-5-10-7;1-8(2,3)7-4-5-9-6-10-7;1-8(2,3)9-4-6-10-7-5-9;1-6-9-7(5-10-6)8(2,3)4;1-8(2,3)7-5-4-6-9-7;1-7(2,3)5-4-10-6(8)9-5;1-7(2,3)6-4-9-5-8-6/h4-7H,8-9H2,1-3H3;7-8H,1-6H3;9H,5-8H2,1-4H3;9H,5-8H2,1-4H3;5H,1-4H3,(H,10,11,12);5-8H2,1-4H3;6H,5H2,1-4H3;4-7H,1-3H3;4-8H2,1-3H3;5H,1-4H3,(H,9,10);5-6H,1-4H3;2*4-6H,1-3H3;4-7H2,1-3H3;5H,1-4H3;4-6H,1-3H3;4H,1-3H3,(H2,8,9);4-5H,1-3H3
InChIKeyHHFWYRLNPPECOV-UHFFFAOYSA-N
MW2799.59 g/mol
LogP40.40
Rot. Bonds4

About 1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole

1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole (PubChem CID 158478567) has the molecular formula C158H277N25O3S7 and a molecular weight of 2799.59 g/mol. Its IUPAC name is 1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole.

Molecular Properties

Compound Name1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole
PubChem CID158478567
Molecular FormulaC158H277N25O3S7
Molecular Weight2799.59 g/mol
Exact Mass2797.03
IUPAC Name1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole
SMILESCC(=O)Nc1nc(C(C)(C)C)cs1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCOCC1.CC(C)(C)N1CCc2ccccc21.CC(C)(C)c1cccnc1.CC(C)(C)c1cccs1.CC(C)(C)c1ccncn1.CC(C)(C)c1cnccn1.CC(C)(C)c1cnn(C(C)(C)C)c1.CC(C)(C)c1csc(N)n1.CC(C)(C)c1cscn1.CC1CCN(C(C)(C)C)CC1.CCc1nc(C(C)(C)C)cs1.CN1CCN(C(C)(C)C)CC1.CNc1nc(C(C)(C)C)cs1.COC1CCN(C(C)(C)C)CC1.Cc1nc(C(C)(C)C)cs1.Cn1cc(C(C)(C)C)cn1
InChIInChI=1S/C12H17N.C11H20N2.C10H21NO.C10H21N.C9H14N2OS.C9H20N2.C9H15NS.C9H13N.C9H19N.C8H14N2S.C8H14N2.2C8H12N2.C8H17NO.C8H13NS.C8H12S.C7H12N2S.C7H11NS/c1-12(2,3)13-9-8-10-6-4-5-7-11(10)13;1-10(2,3)9-7-12-13(8-9)11(4,5)6;1-10(2,3)11-7-5-9(12-4)6-8-11;1-9-5-7-11(8-6-9)10(2,3)4;1-6(12)10-8-11-7(5-13-8)9(2,3)4;1-9(2,3)11-7-5-10(4)6-8-11;1-5-8-10-7(6-11-8)9(2,3)4;1-9(2,3)8-5-4-6-10-7-8;1-9(2,3)10-7-5-4-6-8-10;1-8(2,3)6-5-11-7(9-4)10-6;1-8(2,3)7-5-9-10(4)6-7;1-8(2,3)7-6-9-4-5-10-7;1-8(2,3)7-4-5-9-6-10-7;1-8(2,3)9-4-6-10-7-5-9;1-6-9-7(5-10-6)8(2,3)4;1-8(2,3)7-5-4-6-9-7;1-7(2,3)5-4-10-6(8)9-5;1-7(2,3)6-4-9-5-8-6/h4-7H,8-9H2,1-3H3;7-8H,1-6H3;9H,5-8H2,1-4H3;9H,5-8H2,1-4H3;5H,1-4H3,(H,10,11,12);5-8H2,1-4H3;6H,5H2,1-4H3;4-7H,1-3H3;4-8H2,1-3H3;5H,1-4H3,(H,9,10);5-6H,1-4H3;2*4-6H,1-3H3;4-7H2,1-3H3;5H,1-4H3;4-6H,1-3H3;4H,1-3H3,(H2,8,9);4-5H,1-3H3
InChIKeyHHFWYRLNPPECOV-UHFFFAOYSA-N
XLogP40.40
TPSA285.72 Ų
H-Bond Donors3
H-Bond Acceptors34
Rotatable Bonds4
Heavy Atoms193
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002799.59
LogP ≤ 540.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1034

Analyze 1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole with MolForge

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Launch Full Analysis

Related Compounds

2-cyclopropyl-6-(2-methylpropyl)pyridine;4-cyclopropyl-2-(2-methylpropyl)triazole;3,3-difluoro-1-(2-methylpropyl)piperidine;N,N-dimethyl-4-(2-methylpropyl)-1,3-thiazol-2-amine;2,4-dimethyl-5-(2-methylpropyl)-1,3-thiazole;4,5-dimethyl-1-(2-methylpropyl)triazole;N-ethyl-4-(3-methylbutyl)-1,3-thiazol-2-amine;N-ethyl-4-(2-methylpropyl)-1,3-thiazol-2-amine;5-(3-methylbutyl)-1,3-thiazole;2-methyl-6-(2-methylpropyl)pyridine;2-methyl-4-(2-methylpropyl)triazole;4-methyl-2-(2-methylpropyl)triazole;4-(2-methylpropyl)morpholine;2-(2-methylpropyl)pyrazine;2-(2-methylpropyl)pyridine;2-(2-methylpropyl)pyrimidine;1-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-(2-methylpropyl)-1,3-thiazole;5-(2-methylpropyl)-1,3-thiazole;1-(2-methylpropyl)triazole;2-(2-methylpropyl)triazole
CID 157232677
N-cyclopropyl-N-methyl-1-propan-2-ylpiperidin-4-amine;2-cyclopropyl-6-(2-methylpropyl)pyridine;4-cyclopropyl-2-(2-methylpropyl)triazole;3,3-difluoro-1-(2-methylpropyl)piperidine;N,N-dimethyl-4-(3-methylbutyl)-1,3-thiazol-2-amine;4,5-dimethyl-1-(2-methylpropyl)triazole;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;N-ethyl-4-(3-methylbutyl)-1,3-thiazol-2-amine;4-(3-methylbutyl)-N-propan-2-yl-1,3-thiazol-2-amine;2-(3-methylbutyl)pyridine;5-(3-methylbutyl)-1,3-thiazole;2-(3-methylbutyl)triazole;2-methyl-6-(2-methylpropyl)pyridine;2-methyl-4-(2-methylpropyl)triazole;4-methyl-2-(2-methylpropyl)triazole;4-(2-methylpropyl)morpholine;2-(2-methylpropyl)pyrazine;2-(2-methylpropyl)pyridine;2-(2-methylpropyl)pyrimidine;1-(2-methylpropyl)triazole;2-(2-methylpropyl)triazole
CID 158126927
N-[4-[[(3R)-3-methoxypyrrolidin-1-yl]methyl]-2-pyridinyl]-5-(5-methyl-1H-pyrazol-4-yl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;5-(5-methyl-1H-pyrazol-4-yl)-N-[4-[[(2S)-2-methylpyrrolidin-1-yl]methyl]-2-pyridinyl]-[1,3]thiazolo[5,4-b]pyridin-2-amine;N-[4-[[(2R)-2-methylpyrrolidin-1-yl]methyl]-2-pyridinyl]-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine;N-[4-[[(2S)-2-methylpyrrolidin-1-yl]methyl]-2-pyridinyl]-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine;N-[4-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]-2-pyridinyl]-5-(1H-pyrazol-4-yl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;5-pyridin-4-yl-N-[4-[4-(3,3,3-trifluoropropyl)piperazin-1-yl]-2-pyridinyl]-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 161552644
2-cyclopropyl-6-(2-methylpropyl)pyridine;4-cyclopropyl-2-(2-methylpropyl)triazole;3,3-difluoro-1-(2-methylpropyl)piperidine;N,N-dimethyl-4-(2-methylpropyl)-1,3-thiazol-2-amine;2,4-dimethyl-5-(2-methylpropyl)-1,3-thiazole;4,5-dimethyl-1-(2-methylpropyl)triazole;N-ethyl-4-(2-methylpropyl)-1,3-thiazol-2-amine;2-methyl-6-(2-methylpropyl)pyridine;2-methyl-4-(2-methylpropyl)triazole;4-methyl-2-(2-methylpropyl)triazole;4-(2-methylpropyl)morpholine;2-(2-methylpropyl)pyrazine;2-(2-methylpropyl)pyridine;2-(2-methylpropyl)pyrimidine;1-(2-methylpropyl)pyrrolo[2,3-b]pyridine;2-(2-methylpropyl)-1,3-thiazole;5-(2-methylpropyl)-1,3-thiazole;1-(2-methylpropyl)triazole;2-(2-methylpropyl)triazole
CID 161576503
tris(3,5-dimethylpyridin-2-amine);4,5-dimethylpyridin-2-amine;N,5-dimethylpyridin-2-amine;5,6-dimethylpyridin-2-amine;bis(4,5-dimethyl-1,3-thiazol-2-amine);N,5-dimethyl-1,3-thiazol-2-amine;3-fluoro-5-methylpyridin-2-amine;4-fluoro-5-methylpyridin-2-amine;4-fluoro-5-methylpyrimidin-2-amine;5-methylpyrazin-2-amine;6-methylpyridazin-3-amine;2-methylpyridin-3-amine;2-methylpyridin-4-amine;4-methylpyridin-2-amine;5-methylpyridin-2-amine;5-methylpyridin-3-amine;6-methylpyridin-3-amine;N-(5-methyl-2-pyridinyl)acetamide;2-methylpyrimidin-5-amine;5-methylpyrimidin-2-amine;5-methyl-1,3,4-thiadiazol-2-amine;4-methyl-1,3-thiazol-2-amine;5-methyl-1,3-thiazol-2-amine;4-methylthiophen-2-amine;5-methylthiophen-2-amine;5-methyl-4-(trifluoromethyl)pyrimidin-2-amine;N,N,5-trimethyl-1,3-thiazol-2-amine
CID 161831359
5-(5-methyl-1H-pyrazol-4-yl)-N-[4-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]-2-pyridinyl]-[1,3]thiazolo[5,4-b]pyridin-2-amine;5-(5-methyl-1H-pyrazol-4-yl)-N-[4-[4-(3,3,3-trifluoropropyl)piperazin-1-yl]-2-pyridinyl]-[1,3]thiazolo[5,4-b]pyridin-2-amine;N-[4-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]-2-pyridinyl]-5-(1H-pyrazol-4-yl)-[1,3]thiazolo[5,4-b]pyridin-2-amine;N-[4-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]-2-pyridinyl]-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine;5-pyridin-4-yl-N-[4-[4-(3,3,3-trifluoropropyl)piperazin-1-yl]-2-pyridinyl]-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 164058335
3-[[2-ethoxyethyl(ethyl)amino]methyl]-N-[6-methyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[[ethyl(2-methylbutan-2-yl)amino]methyl]-N-[6-methyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-ethyl-N-[6-methyl-3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-ethyl-N-(6-methyl-3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-yl)-1,2-thiazol-5-amine;6-methyl-N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine
CID 123677597
3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine
CID 157246391
5-[(1-benzylpiperidin-4-yl)methyl]-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;5-(cyclohexen-1-ylmethyl)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;5-(cyclohexylmethyl)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;5-(4-methylpentyl)-3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine;3-(1-methylpyrazol-4-yl)-5-pentyl-1H-pyrrolo[2,3-b]pyridine;4-[4-[[3-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]methyl]cyclohexyl]morpholine;morpholin-4-yl-[4-(5-pentyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazol-2-yl]methanone
CID 157349625
3-tert-butyl-1-azabicyclo[2.2.2]octane;4-tert-butyl-1-hydroxypiperidine;2-tert-butyl-1H-imidazole;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;4-tert-butyl-1-methylimidazole;4-tert-butylmorpholine;1-tert-butylpiperazine;2-tert-butylpiperazine;1-tert-butylpiperidine;2-tert-butylpiperidine;3-tert-butylpiperidine;4-tert-butylpiperidine;2-tert-butylpyrazine;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;3-tert-butyl-1H-pyrrole;1-tert-butylpyrrolidine;2-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;5-tert-butyl-1H-1,2,4-triazole
CID 157371049
tert-butylbenzene;2-tert-butylpyrazine;2-tert-butyl-1,3,4-thiadiazole;2-tert-butyl-[1,3]thiazolo[5,4-b]pyridine;octakis(2,2-dimethylpropane);1H-imidazole;methane;1,3-oxazole;pyridine;2H-pyrrole;3H-pyrrolo[3,2-b]pyridine;bis(7H-pyrrolo[3,4-d]pyrimidine);1,3-thiazole
CID 157417324
3a,7a-dihydro-1,3-benzoxazole;2-tert-butyl-3a,7a-dihydro-1,3-benzoxazole;8-tert-butyl-1,7-naphthyridine;2-tert-butyl-4,5,6,7-tetrahydro-[1,3]thiazolo[4,5-c]pyridine;2-tert-butyl-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine;2,3-dihydro-1H-isoindole;octakis(2,2-dimethylpropane);ethane;1,7-naphthyridine;quinoline;1,2,3,4-tetrahydroisoquinoline;4,5,6,7-tetrahydro-[1,3]thiazolo[4,5-c]pyridine;4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine;[1,2,4]triazolo[1,5-a]pyridine
CID 157476411

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole?
The IUPAC name of 1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole (CID 158478567) is 1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole.
What is the SMILES notation for 1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole?
The canonical SMILES for 1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole is CC(=O)Nc1nc(C(C)(C)C)cs1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCOCC1.CC(C)(C)N1CCc2ccccc21.CC(C)(C)c1cccnc1.CC(C)(C)c1cccs1.CC(C)(C)c1ccncn1.CC(C)(C)c1cnccn1.CC(C)(C)c1cnn(C(C)(C)C)c1.CC(C)(C)c1csc(N)n1.CC(C)(C)c1cscn1.CC1CCN(C(C)(C)C)CC1.CCc1nc(C(C)(C)C)cs1.CN1CCN(C(C)(C)C)CC1.CNc1nc(C(C)(C)C)cs1.COC1CCN(C(C)(C)C)CC1.Cc1nc(C(C)(C)C)cs1.Cn1cc(C(C)(C)C)cn1.
What is the InChIKey of 1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole?
The InChIKey is HHFWYRLNPPECOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N.C11H20N2.C10H21NO.C10H21N.C9H14N2OS.C9H20N2.C9H15NS.C9H13N.C9H19N.C8H14N2S.C8H14N2.2C8H12N2.C8H17NO.C8H13NS.C8H12S.C7H12N2S.C7H11NS/c1-12(2,3)13-9-8-10-6-4-5-7-11(10)13;1-10(2,3)9-7-12-13(8-9)11(4,5)6;1-10(2,3)11-7-5-9(12-4)6-8-11;1-9-5-7-11(8-6-9)10(2,3)4;1-6(12)10-8-11-7(5-13-8)9(2,3)4;1-9(2,3)11-7-5-10(4)6-8-11;1-5-8-10-7(6-11-8)9(2,3)4;1-9(2,3)8-5-4-6-10-7-8;1-9(2,3)10-7-5-4-6-8-10;1-8(2,3)6-5-11-7(9-4)10-6;1-8(2,3)7-5-9-10(4)6-7;1-8(2,3)7-6-9-4-5-10-7;1-8(2,3)7-4-5-9-6-10-7;1-8(2,3)9-4-6-10-7-5-9;1-6-9-7(5-10-6)8(2,3)4;1-8(2,3)7-5-4-6-9-7;1-7(2,3)5-4-10-6(8)9-5;1-7(2,3)6-4-9-5-8-6/h4-7H,8-9H2,1-3H3;7-8H,1-6H3;9H,5-8H2,1-4H3;9H,5-8H2,1-4H3;5H,1-4H3,(H,10,11,12);5-8H2,1-4H3;6H,5H2,1-4H3;4-7H,1-3H3;4-8H2,1-3H3;5H,1-4H3,(H,9,10);5-6H,1-4H3;2*4-6H,1-3H3;4-7H2,1-3H3;5H,1-4H3;4-6H,1-3H3;4H,1-3H3,(H2,8,9);4-5H,1-3H3.
What are the key properties of 1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole?
1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole has a molecular weight of 2799.59 g/mol, XLogP of 40.40, 4 rotatable bonds, 3 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-2,3-dihydroindole;4-tert-butyl-2-ethyl-1,3-thiazole;1-tert-butyl-4-methoxypiperidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidine;4-tert-butyl-1-methylpyrazole;4-tert-butyl-N-methyl-1,3-thiazol-2-amine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butylmorpholine;1-tert-butylpiperidine;2-tert-butylpyrazine;3-tert-butylpyridine;4-tert-butylpyrimidine;4-tert-butyl-1,3-thiazol-2-amine;4-tert-butyl-1,3-thiazole;N-(4-tert-butyl-1,3-thiazol-2-yl)acetamide;2-tert-butylthiophene;1,4-ditert-butylpyrazole is sourced from PubChem (CID 158478567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).