2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran

C206H352N24O6S4 — CID 158126444

IUPAC2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran
SMILESCC(C)(C)C1=CC=COC1.CC(C)(C)C1=CC=CSC1.CC(C)(C)C1=CC=NC1.CC(C)(C)C1=NC=CC1.CC(C)(C)C1C=COC=C1.CC(C)(C)C1C=CSC=C1.CC(C)(C)C1CCNC1.CC(C)(C)C1CCNCC1.CC(C)(C)C1COCCN1.CC(C)(C)C1NCCCN1.CC(C)(C)N1CCCC1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCOCC1.CC(C)(C)c1ccccn1.CC(C)(C)c1cccnc1.CC(C)(C)c1ccco1.CC(C)(C)c1cccs1.CC(C)(C)c1ccncc1.CC(C)(C)c1ccncn1.CC(C)(C)c1cncnc1.CC(C)(C)c1ncccn1.CC(C)(C)c1ncco1.CC(C)(C)c1nccs1.CC(C)(C)n1cccc1.CC(C)(C)n1ccnc1
InChIInChI=1S/C9H19N.2C9H13N.C9H19N.C9H13N.2C9H14O.2C9H14S.2C8H12N2.C8H18N2.C8H12N2.2C8H17NO.C8H17N.C8H13N.C8H17N.2C8H13N.C8H12O.C8H12S.C7H12N2.C7H11NO.C7H11NS/c2*1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)8-5-4-6-10-7-8;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)8-4-6-10-7-5-8;1-9(2,3)8-5-4-6-10-7-8;1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)8-5-4-6-10-7-8;1-8(2,3)7-4-9-6-10-5-7;1-8(2,3)7-4-5-9-6-10-7;2*1-8(2,3)7-9-5-4-6-10-7;1-8(2,3)9-4-6-10-7-5-9;1-8(2,3)7-6-10-5-4-9-7;2*1-8(2,3)7-4-5-9-6-7;2*1-8(2,3)9-6-4-5-7-9;3*1-8(2,3)7-5-4-6-9-7;1-7(2,3)9-5-4-8-6-9;2*1-7(2,3)6-8-4-5-9-6/h8,10H,4-7H2,1-3H3;2*4-7H,1-3H3;4-8H2,1-3H3;4-7H,1-3H3;4-8H,1-3H3;4-6H,7H2,1-3H3;4-8H,1-3H3;4-6H,7H2,1-3H3;2*4-6H,1-3H3;7,9-10H,4-6H2,1-3H3;4-6H,1-3H3;4-7H2,1-3H3;7,9H,4-6H2,1-3H3;7,9H,4-6H2,1-3H3;4-5H,6H2,1-3H3;4-7H2,1-3H3;4-7H,1-3H3;4,6H,5H2,1-3H3;3*4-6H,1-3H3;2*4-5H,1-3H3
InChIKeyFSFSDOUAHUYXLL-UHFFFAOYSA-N
MW3389.51 g/mol
LogP53.57
Rot. Bonds

About 2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran

2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran (PubChem CID 158126444) has the molecular formula C206H352N24O6S4 and a molecular weight of 3389.51 g/mol. Its IUPAC name is 2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran.

Molecular Properties

Compound Name2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran
PubChem CID158126444
Molecular FormulaC206H352N24O6S4
Molecular Weight3389.51 g/mol
Exact Mass3386.69
IUPAC Name2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran
SMILESCC(C)(C)C1=CC=COC1.CC(C)(C)C1=CC=CSC1.CC(C)(C)C1=CC=NC1.CC(C)(C)C1=NC=CC1.CC(C)(C)C1C=COC=C1.CC(C)(C)C1C=CSC=C1.CC(C)(C)C1CCNC1.CC(C)(C)C1CCNCC1.CC(C)(C)C1COCCN1.CC(C)(C)C1NCCCN1.CC(C)(C)N1CCCC1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCOCC1.CC(C)(C)c1ccccn1.CC(C)(C)c1cccnc1.CC(C)(C)c1ccco1.CC(C)(C)c1cccs1.CC(C)(C)c1ccncc1.CC(C)(C)c1ccncn1.CC(C)(C)c1cncnc1.CC(C)(C)c1ncccn1.CC(C)(C)c1ncco1.CC(C)(C)c1nccs1.CC(C)(C)n1cccc1.CC(C)(C)n1ccnc1
InChIInChI=1S/C9H19N.2C9H13N.C9H19N.C9H13N.2C9H14O.2C9H14S.2C8H12N2.C8H18N2.C8H12N2.2C8H17NO.C8H17N.C8H13N.C8H17N.2C8H13N.C8H12O.C8H12S.C7H12N2.C7H11NO.C7H11NS/c2*1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)8-5-4-6-10-7-8;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)8-4-6-10-7-5-8;1-9(2,3)8-5-4-6-10-7-8;1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)8-5-4-6-10-7-8;1-8(2,3)7-4-9-6-10-5-7;1-8(2,3)7-4-5-9-6-10-7;2*1-8(2,3)7-9-5-4-6-10-7;1-8(2,3)9-4-6-10-7-5-9;1-8(2,3)7-6-10-5-4-9-7;2*1-8(2,3)7-4-5-9-6-7;2*1-8(2,3)9-6-4-5-7-9;3*1-8(2,3)7-5-4-6-9-7;1-7(2,3)9-5-4-8-6-9;2*1-7(2,3)6-8-4-5-9-6/h8,10H,4-7H2,1-3H3;2*4-7H,1-3H3;4-8H2,1-3H3;4-7H,1-3H3;4-8H,1-3H3;4-6H,7H2,1-3H3;4-8H,1-3H3;4-6H,7H2,1-3H3;2*4-6H,1-3H3;7,9-10H,4-6H2,1-3H3;4-6H,1-3H3;4-7H2,1-3H3;7,9H,4-6H2,1-3H3;7,9H,4-6H2,1-3H3;4-5H,6H2,1-3H3;4-7H2,1-3H3;4-7H,1-3H3;4,6H,5H2,1-3H3;3*4-6H,1-3H3;2*4-5H,1-3H3
InChIKeyFSFSDOUAHUYXLL-UHFFFAOYSA-N
XLogP53.57
TPSA322.33 Ų
H-Bond Donors5
H-Bond Acceptors34
Rotatable Bonds
Heavy Atoms240
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003389.51
LogP ≤ 553.57
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1034

Analyze 2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran with MolForge

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Launch Full Analysis

Related Compounds

CID 157181702
CID 157181702
N-[2-[5-(furan-2-yl)-2-pyridinyl]ethyl]-4-methyl-2-(oxan-4-yl)imidazo[1,5-a]pyrimidine-8-carboxamide;4-methyl-2-(oxan-4-yl)-N-[2-(4-propoxycyclohexyl)ethyl]imidazo[1,5-a]pyrimidine-8-carboxamide;4-methyl-2-piperidin-4-yl-N-[2,2,2-trifluoro-1-(1,3-thiazol-2-yl)ethyl]imidazo[1,5-a]pyrimidine-8-carboxamide;4-methyl-2-piperidin-4-yl-N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)imidazo[1,5-a]pyrimidine-8-carboxamide;4-methyl-2-pyridin-3-yl-N-[2,2,2-trifluoro-1-(4-propoxycyclohexyl)ethyl]imidazo[1,5-a]pyrimidine-8-carboxamide;4-methyl-2-pyridin-3-yl-N-(2,2,2-trifluoro-1-thiophen-2-ylethyl)imidazo[1,5-a]pyrimidine-8-carboxamide
CID 157655987
1-tert-butyl-4-propan-2-ylcyclohexane;2-tert-butyl-5-propan-2-ylthiophene;1-chloro-2-propan-2-ylbenzene;1-chloro-3-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;1,1-difluoro-4-propan-2-ylcyclohexane;1,1-dimethyl-4-propan-2-ylcyclohexane;1,4-di(propan-2-yl)cyclohexane;1-ethyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;2-phenyl-5-propan-2-ylthiophene;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylfuran;2-propan-2-yl-1,3-oxazole;2-propan-2-yloxolane;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;4-propan-2-ylpyrimidine;5-propan-2-yl-3H-pyrrole;2-propan-2-ylpyrrolidine;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;2,2,3-trimethylbutan-1-ol
CID 157759188
CID 158046770
CID 158046770
cumene;2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;methane;2-methyl-5-propan-2-yl-1H-imidazole;pentakis(2-methyl-5-propan-2-ylpyridine);1-propan-2-ylcyclopenta-1,3-diene;2-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;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;bis(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);4-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;4-propan-2-ylpyrimidine;4-propan-2-yl-3H-pyrrole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;bis(5-propan-2-yl-2-(trifluoromethyl)pyridine)
CID 158218996
2-Amino-5-[2-fluoro-5-(furan-3-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[2-fluoro-5-(2-methylpyrimidin-5-yl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-5-[2-fluoro-5-(1,3-oxazol-4-yl)phenyl]-3-methyl-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[2-fluoro-5-(1,3-oxazol-5-yl)phenyl]-3-methyl-5-[4-(trifluoromethyl)-2-pyridinyl]imidazol-4-one;2-amino-5-[2-fluoro-5-(1,3-thiazol-5-yl)phenyl]-3-methyl-5-[5-(trifluoromethyl)-3-pyridinyl]imidazol-4-one;2-amino-5-(2-fluoro-5-thiophen-3-ylphenyl)-3-methyl-5-[6-(trifluoromethyl)-2-pyridinyl]imidazol-4-one
CID 158760585
(5Z)-5-[[2-[4-[[(3-fluoro-6-thiophen-3-yl-2-pyridinyl)methylamino]methyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[[[2-(furan-2-yl)-4-pyridinyl]methylamino]methyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[3-[2-(furan-2-yl)-3-pyridinyl]propyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[[methyl-[(6-thiophen-2-yl-2-pyridinyl)methyl]amino]methyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[[(3-thiophen-2-ylphenyl)methylamino]methyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[3-[2-[5-(trifluoromethyl)thiophen-2-yl]-3-pyridinyl]propyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione
CID 159171188
CID 159328819
CID 159328819
3-[2-[6-(dimethylamino)-3-pyridinyl]-1,3-thiazol-4-yl]propanal;3-(1H-imidazol-2-yl)propanal;3-[2-(6-isocyano-3-pyridinyl)-1,3-thiazol-4-yl]propanal;3-(1-methylimidazol-2-yl)propanal;3-(1,3-oxazol-2-yl)propanal;[5-[4-(3-oxopropyl)-1,3-thiazol-2-yl]-2-pyridinyl] acetate;3-(1,3-thiazol-2-yl)propanal;3-[2-[6-(trifluoromethoxy)-3-pyridinyl]-1,3-thiazol-4-yl]propanal;3-[2-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazol-4-yl]propanal
CID 159380635
(5Z)-5-[[2-[4-[[(3-fluoro-6-thiophen-3-yl-2-pyridinyl)methylamino]methyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[[[2-(furan-2-yl)-4-pyridinyl]methylamino]methyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[3-[2-(furan-2-yl)-3-pyridinyl]propyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-[[methyl-[(6-thiophen-2-yl-2-pyridinyl)methyl]amino]methyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[[(3-thiophen-2-ylphenyl)methylamino]methyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[3-[2-[5-(trifluoromethyl)thiophen-2-yl]-3-pyridinyl]propyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione
CID 159955520
(5Z)-5-[[2-[4-[[[2-(furan-2-yl)-4-pyridinyl]methylamino]methyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[[[2-(furan-3-yl)-4-pyridinyl]methylamino]methyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[3-[2-(furan-2-yl)-3-pyridinyl]propyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-[[methyl-[(6-thiophen-2-yl-2-pyridinyl)methyl]amino]methyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[[(3-thiophen-2-ylphenyl)methylamino]methyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[4-[3-[2-[5-(trifluoromethyl)thiophen-2-yl]-3-pyridinyl]propyl]piperidin-1-yl]pyrimidin-4-yl]methylidene]thiolane-2,4-dione
CID 160003419
6-[4-(1,1-Difluoroethoxy)phenyl]-1-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-(4-methoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-(4-phenoxyphenyl)-3-(trifluoromethyl)imidazo[1,5-a]pyridine;6-phenyl-3-(trifluoromethyl)imidazo[1,5-a]pyridine;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-benzothiazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-oxazole;2-[3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]-1,3-thiazole
CID 160025166

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran?
The IUPAC name of 2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran (CID 158126444) is 2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran.
What is the SMILES notation for 2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran?
The canonical SMILES for 2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran is CC(C)(C)C1=CC=COC1.CC(C)(C)C1=CC=CSC1.CC(C)(C)C1=CC=NC1.CC(C)(C)C1=NC=CC1.CC(C)(C)C1C=COC=C1.CC(C)(C)C1C=CSC=C1.CC(C)(C)C1CCNC1.CC(C)(C)C1CCNCC1.CC(C)(C)C1COCCN1.CC(C)(C)C1NCCCN1.CC(C)(C)N1CCCC1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCOCC1.CC(C)(C)c1ccccn1.CC(C)(C)c1cccnc1.CC(C)(C)c1ccco1.CC(C)(C)c1cccs1.CC(C)(C)c1ccncc1.CC(C)(C)c1ccncn1.CC(C)(C)c1cncnc1.CC(C)(C)c1ncccn1.CC(C)(C)c1ncco1.CC(C)(C)c1nccs1.CC(C)(C)n1cccc1.CC(C)(C)n1ccnc1.
What is the InChIKey of 2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran?
The InChIKey is FSFSDOUAHUYXLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.2C9H13N.C9H19N.C9H13N.2C9H14O.2C9H14S.2C8H12N2.C8H18N2.C8H12N2.2C8H17NO.C8H17N.C8H13N.C8H17N.2C8H13N.C8H12O.C8H12S.C7H12N2.C7H11NO.C7H11NS/c2*1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)8-5-4-6-10-7-8;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)8-4-6-10-7-5-8;1-9(2,3)8-5-4-6-10-7-8;1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)8-5-4-6-10-7-8;1-8(2,3)7-4-9-6-10-5-7;1-8(2,3)7-4-5-9-6-10-7;2*1-8(2,3)7-9-5-4-6-10-7;1-8(2,3)9-4-6-10-7-5-9;1-8(2,3)7-6-10-5-4-9-7;2*1-8(2,3)7-4-5-9-6-7;2*1-8(2,3)9-6-4-5-7-9;3*1-8(2,3)7-5-4-6-9-7;1-7(2,3)9-5-4-8-6-9;2*1-7(2,3)6-8-4-5-9-6/h8,10H,4-7H2,1-3H3;2*4-7H,1-3H3;4-8H2,1-3H3;4-7H,1-3H3;4-8H,1-3H3;4-6H,7H2,1-3H3;4-8H,1-3H3;4-6H,7H2,1-3H3;2*4-6H,1-3H3;7,9-10H,4-6H2,1-3H3;4-6H,1-3H3;4-7H2,1-3H3;7,9H,4-6H2,1-3H3;7,9H,4-6H2,1-3H3;4-5H,6H2,1-3H3;4-7H2,1-3H3;4-7H,1-3H3;4,6H,5H2,1-3H3;3*4-6H,1-3H3;2*4-5H,1-3H3.
What are the key properties of 2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran?
2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran has a molecular weight of 3389.51 g/mol, XLogP of 53.57, 0 rotatable bonds, 5 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-1,3-diazinane;2-tert-butylfuran;1-tert-butylimidazole;3-tert-butylmorpholine;4-tert-butylmorpholine;2-tert-butyl-1,3-oxazole;1-tert-butylpiperidine;4-tert-butylpiperidine;3-tert-butyl-2H-pyran;4-tert-butyl-4H-pyran;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;5-tert-butylpyrimidine;1-tert-butylpyrrole;2-tert-butyl-3H-pyrrole;3-tert-butyl-2H-pyrrole;1-tert-butylpyrrolidine;3-tert-butylpyrrolidine;2-tert-butyl-1,3-thiazole;2-tert-butylthiophene;3-tert-butyl-2H-thiopyran;4-tert-butyl-4H-thiopyran is sourced from PubChem (CID 158126444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).