2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole

C170H273N37O12 — CID 158206831

IUPAC2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole
SMILESCC(C)c1ccc2cn(C)cc2c1.CC(C)c1ccc[nH]1.CC(C)c1ccco1.CC(C)c1ccn(C)n1.CC(C)c1ccnc(CN2CCC2)n1.CC(C)c1ccnn1C.CC(C)c1cnc[nH]1.CC(C)c1cncc(CN2CCC2)n1.CC(C)c1cnco1.CC(C)c1cnn(C)c1.CC(C)c1ncc[nH]1.CC(C)c1ncco1.CC(C)c1ncn[nH]1.CCC(O)COc1cc(C)nc(C(C)C)n1.CCC(O)COc1cncc(C(C)C)n1.CCC(O)COc1nccc(C(C)C)n1.Cc1cc(C(C)C)n(C)n1.Cc1cc(C(C)C)no1.Cc1nn(C)c(C)c1C(C)C.Cc1nnc(C(C)C)o1.Cc1noc(C(C)C)c1C
InChIInChI=1S/C12H20N2O2.C12H15N.2C11H17N3.2C11H18N2O2.C9H16N2.C8H14N2.C8H13NO.3C7H12N2.C7H11NO.C7H11N.C7H10O.C6H10N2O.2C6H10N2.2C6H9NO.C5H9N3/c1-5-10(15)7-16-11-6-9(4)13-12(14-11)8(2)3;1-9(2)10-4-5-11-7-13(3)8-12(11)6-10;1-9(2)10-4-5-12-11(13-10)8-14-6-3-7-14;1-9(2)11-7-12-6-10(13-11)8-14-4-3-5-14;1-4-9(14)7-15-11-6-12-5-10(13-11)8(2)3;1-4-9(14)7-15-11-12-6-5-10(13-11)8(2)3;1-6(2)9-7(3)10-11(5)8(9)4;1-6(2)8-5-7(3)9-10(8)4;1-5(2)8-6(3)7(4)9-10-8;1-6(2)7-4-8-9(3)5-7;1-6(2)7-4-5-9(3)8-7;1-6(2)7-4-5-8-9(7)3;1-5(2)7-4-6(3)9-8-7;2*1-6(2)7-4-3-5-8-7;1-4(2)6-8-7-5(3)9-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-4(2)5-6-3-7-8-5/h6,8,10,15H,5,7H2,1-4H3;4-9H,1-3H3;4-5,9H,3,6-8H2,1-2H3;6-7,9H,3-5,8H2,1-2H3;2*5-6,8-9,14H,4,7H2,1-3H3;6H,1-5H3;5-6H,1-4H3;5H,1-4H3;3*4-6H,1-3H3;4-5H,1-3H3;3-6,8H,1-2H3;3-6H,1-2H3;4H,1-3H3;2*3-5H,1-2H3,(H,7,8);2*3-5H,1-2H3;3-4H,1-2H3,(H,6,7,8)
InChIKeyGBPDZTRNRCCJAS-UHFFFAOYSA-N
MW3027.30 g/mol
LogP39.27
Rot. Bonds37

About 2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole

2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole (PubChem CID 158206831) has the molecular formula C170H273N37O12 and a molecular weight of 3027.30 g/mol. Its IUPAC name is 2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole.

Molecular Properties

Compound Name2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole
PubChem CID158206831
Molecular FormulaC170H273N37O12
Molecular Weight3027.30 g/mol
Exact Mass3025.19
IUPAC Name2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole
SMILESCC(C)c1ccc2cn(C)cc2c1.CC(C)c1ccc[nH]1.CC(C)c1ccco1.CC(C)c1ccn(C)n1.CC(C)c1ccnc(CN2CCC2)n1.CC(C)c1ccnn1C.CC(C)c1cnc[nH]1.CC(C)c1cncc(CN2CCC2)n1.CC(C)c1cnco1.CC(C)c1cnn(C)c1.CC(C)c1ncc[nH]1.CC(C)c1ncco1.CC(C)c1ncn[nH]1.CCC(O)COc1cc(C)nc(C(C)C)n1.CCC(O)COc1cncc(C(C)C)n1.CCC(O)COc1nccc(C(C)C)n1.Cc1cc(C(C)C)n(C)n1.Cc1cc(C(C)C)no1.Cc1nn(C)c(C)c1C(C)C.Cc1nnc(C(C)C)o1.Cc1noc(C(C)C)c1C
InChIInChI=1S/C12H20N2O2.C12H15N.2C11H17N3.2C11H18N2O2.C9H16N2.C8H14N2.C8H13NO.3C7H12N2.C7H11NO.C7H11N.C7H10O.C6H10N2O.2C6H10N2.2C6H9NO.C5H9N3/c1-5-10(15)7-16-11-6-9(4)13-12(14-11)8(2)3;1-9(2)10-4-5-11-7-13(3)8-12(11)6-10;1-9(2)10-4-5-12-11(13-10)8-14-6-3-7-14;1-9(2)11-7-12-6-10(13-11)8-14-4-3-5-14;1-4-9(14)7-15-11-6-12-5-10(13-11)8(2)3;1-4-9(14)7-15-11-12-6-5-10(13-11)8(2)3;1-6(2)9-7(3)10-11(5)8(9)4;1-6(2)8-5-7(3)9-10(8)4;1-5(2)8-6(3)7(4)9-10-8;1-6(2)7-4-8-9(3)5-7;1-6(2)7-4-5-9(3)8-7;1-6(2)7-4-5-8-9(7)3;1-5(2)7-4-6(3)9-8-7;2*1-6(2)7-4-3-5-8-7;1-4(2)6-8-7-5(3)9-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-4(2)5-6-3-7-8-5/h6,8,10,15H,5,7H2,1-4H3;4-9H,1-3H3;4-5,9H,3,6-8H2,1-2H3;6-7,9H,3-5,8H2,1-2H3;2*5-6,8-9,14H,4,7H2,1-3H3;6H,1-5H3;5-6H,1-4H3;5H,1-4H3;3*4-6H,1-3H3;4-5H,1-3H3;3-6,8H,1-2H3;3-6H,1-2H3;4H,1-3H3;2*3-5H,1-2H3,(H,7,8);2*3-5H,1-2H3;3-4H,1-2H3,(H,6,7,8)
InChIKeyGBPDZTRNRCCJAS-UHFFFAOYSA-N
XLogP39.27
TPSA588.69 Ų
H-Bond Donors7
H-Bond Acceptors45
Rotatable Bonds37
Heavy Atoms219
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003027.30
LogP ≤ 539.27
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1045

Analyze 2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole with MolForge

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Related Compounds

2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;2-(azetidin-1-yl)-4-propan-2-ylpyridine;1,2-dimethoxy-4-propan-2-ylbenzene;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;1-methyl-2-propan-2-ylpyrrole;bis(2-propan-2-ylfuran);bis(2-propan-2-yl-1H-imidazole);5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(5-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;2-propan-2-ylquinoxaline;5-propan-2-yl-1H-1,2,4-triazole;1-propan-2-yl-3-(trifluoromethyl)benzene
CID 157062526
2-(Azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyridine;4-(azetidin-1-ylmethyl)-2-propan-2-ylpyridine;5-(azetidin-1-ylmethyl)-2-propan-2-ylpyridine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;2-(azetidin-1-yl)-4-propan-2-ylpyridine;2-(azetidin-1-yl)-6-propan-2-ylpyridine;methane;5-methyl-3-propan-2-yl-1,2-oxazole;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(piperidin-1-ylmethyl)-4-propan-2-ylpyrimidine;2-propan-2-ylfuran;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;2-propan-2-ylpyridine;2-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;bis(2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)pyridine);2-propan-2-yl-6-(pyrrolidin-1-ylmethyl)pyridine
CID 157172849
2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;methane;1-methyl-1-propan-2-ylcyclohexane;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;4-methyl-2-propan-2-ylpyrimidine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(piperidin-1-ylmethyl)-4-propan-2-ylpyrimidine;propan-2-ylcyclopentane;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1H-pyrazole;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;2-propan-2-yl-1H-pyrrole;4-propan-2-yl-2-(pyrrolidin-1-ylmethyl)pyrimidine;bis(5-propan-2-yl-1H-1,2,4-triazole)
CID 157477533
furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[3,2-d]pyrimidine;1H-imidazo[4,5-b]pyrazine;bis(1H-imidazo[4,5-b]pyridine);bis(2H-imidazo[4,5-b]pyridine);bis(5H-imidazo[4,5-c]pyridazine);2H-imidazo[4,5-c]pyridine;bis(3H-imidazo[4,5-c]pyridine);1H-imidazo[4,5-d]pyridazine;methane;[1,2]oxazolo[4,5-b]pyrazine;[1,3]oxazolo[4,5-b]pyridine;[1,3]oxazolo[5,4-b]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;[1,2]oxazolo[5,4-d]pyrimidine;bis(7H-purine);1H-pyrazolo[3,4-b]pyrazine;1H-pyrazolo[3,4-d]pyrimidine;5H-pyrrolo[3,2-c]pyridazine;7H-pyrrolo[2,3-c]pyridazine;1H-pyrrolo[2,3-d]pyridazine;5H-pyrrolo[3,2-d]pyrimidine;pyrrolo[2,1-f][1,2,4]triazine
CID 157575894
1,4-dimethylpiperazine;1-ethylazepane;1-ethylazetidine;1-ethylaziridine;1-ethyl-3-methylimidazolidine;1-ethyl-4-methylpiperazine;1-ethyl-2-methylpyrazolidine;2-ethyl-1,2-oxazolidine;3-ethyl-1,3-oxazolidine;1-ethylpiperidine;1-ethylpyrrolidine;2-methyl-4,5-dihydro-1,3-oxazole;2-methylfuran;1-methylimidazole;2-methyl-1H-imidazole;5-methyl-1H-imidazole;4-methylmorpholine;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;bis(2-methyl-2H-oxete);1-methylpiperidine;2-methylpyrazine;1-methylpyrazole;4-methyl-1H-pyrazole;3-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;bis(1-methyltetrazole);2-methyltetrazole;2-methyl-1,3,5-triazine;bis(1-methyltriazole);1-methyl-1,2,4-triazole;2-methyltriazole;4-methyl-1,2,4-triazole
CID 157691903
1,3-benzodioxole;1,3-dihydro-2-benzofuran;2,3-dihydro-1H-indene;3,4-dihydro-1H-isochromene;henicosakis(2-methylpropane);1-phenylimidazole;4-phenylmorpholine;2-phenyl-1,3,4-oxadiazole;2-phenyl-1,3-oxazole;5-phenyl-1,2-oxazole;1-phenylpiperazine;1-phenylpiperidine;1-phenylpyrazole;5-phenyl-1H-pyrazole;2-phenylpyridine;3-phenylpyridine;4-phenylpyridine;2-phenylpyrimidine;2-phenyltriazole;2-pyridin-3-ylpyrimidine;1,2,3,4-tetrahydronaphthalene;1,2,3,4-tetrahydroquinoline
CID 157937048
cumene;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1,3-benzoxazole;2-propan-2-yl-3,4-dihydropyrido[1,2-a]pyrazine-1,6-dione;3-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-yl-1H-imidazo[4,5-b]pyridine;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1H-pyrazole;2-propan-2-ylpyrimidine;5-propan-2-yl-1H-1,2,4-triazole
CID 157979101
ethane;5-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1-benzofuran;5-propan-2-yl-1-benzofuran;5-propan-2-yl-3H-2-benzofuran-1-one;5-propan-2-yl-1,2-benzoxazole;6-propan-2-yl-1,2-benzoxazole;6-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-2,3-dihydro-1-benzofuran;3-propan-2-yl-2,5-dihydropyrazolo[3,4-d]pyrimidin-4-one;3-propan-2-ylfuro[3,2-b]pyridine;6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrazine;6-propan-2-yl-7H-[1,2,4]triazolo[4,3-a]pyrazin-8-one;6-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine;6-propan-2-yl-[1,2,4]triazolo[1,5-b]pyridazine;6-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazine;bis(7-propan-2-yl-2H-triazolo[4,5-b]pyridine)
CID 157990219
6-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;2-(4-methylphenyl)-5-propan-2-yltetrazole;tetrakis(6-methyl-2-propan-2-ylimidazo[1,2-a]pyridine);7-methyl-2-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-2-propan-2-ylindole;1-methyl-3-propan-2-ylindole;5-methyl-3-propan-2-yl-1,2-oxazole;6-phenyl-2-propan-2-ylimidazo[1,2-a]pyridine;2-phenyl-5-propan-2-yl-1,3,4-oxadiazole;2-phenyl-4-propan-2-yl-1,3-oxazole;5-phenyl-2-propan-2-yl-1,3-oxazole;5-phenyl-3-propan-2-yl-1,2-oxazole;2-propan-2-ylimidazo[1,2-a]pyridine;3-propan-2-ylimidazo[1,2-a]pyridine;N-(2-propan-2-ylimidazo[1,2-a]pyridin-6-yl)acetamide;2-propan-2-ylimidazo[1,2-a]pyrimidine;2-propan-2-yl-1H-indole;3-propan-2-yl-1H-indole
CID 158215572
CID 158314564
CID 158314564
2-(Azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyridine;4-(azetidin-1-ylmethyl)-2-propan-2-ylpyridine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;2-(azetidin-1-yl)-4-propan-2-ylpyridine;2-(azetidin-1-yl)-6-propan-2-ylpyridine;methane;5-methyl-3-propan-2-yl-1,2-oxazole;2-propan-2-ylfuran;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-[(4-propan-2-ylphenyl)methyl]azetidine;1-[(4-propan-2-ylphenyl)methyl]pyrrolidine;2-propan-2-ylpyrazine;4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-[(4-propan-2-ylpyrimidin-2-yl)methyl]morpholine;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)pyridine;2-propan-2-yl-6-(pyrrolidin-1-ylmethyl)pyridine
CID 158477853
2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyridine;4-(azetidin-1-ylmethyl)-2-propan-2-ylpyridine;5-(azetidin-1-ylmethyl)-2-propan-2-ylpyridine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;2-(azetidin-1-yl)-4-propan-2-ylpyridine;2-(azetidin-1-yl)-6-propan-2-ylpyridine;1-methyl-2-propan-2-ylimidazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(piperidin-1-ylmethyl)-4-propan-2-ylpyrimidine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;4-(6-propan-2-ylpyrazin-2-yl)morpholine;3-propan-2-ylpyridazine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)pyridine;2-propan-2-yl-6-(pyrrolidin-1-ylmethyl)pyridine
CID 158673998

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole?
The IUPAC name of 2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole (CID 158206831) is 2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole.
What is the SMILES notation for 2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole?
The canonical SMILES for 2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole is CC(C)c1ccc2cn(C)cc2c1.CC(C)c1ccc[nH]1.CC(C)c1ccco1.CC(C)c1ccn(C)n1.CC(C)c1ccnc(CN2CCC2)n1.CC(C)c1ccnn1C.CC(C)c1cnc[nH]1.CC(C)c1cncc(CN2CCC2)n1.CC(C)c1cnco1.CC(C)c1cnn(C)c1.CC(C)c1ncc[nH]1.CC(C)c1ncco1.CC(C)c1ncn[nH]1.CCC(O)COc1cc(C)nc(C(C)C)n1.CCC(O)COc1cncc(C(C)C)n1.CCC(O)COc1nccc(C(C)C)n1.Cc1cc(C(C)C)n(C)n1.Cc1cc(C(C)C)no1.Cc1nn(C)c(C)c1C(C)C.Cc1nnc(C(C)C)o1.Cc1noc(C(C)C)c1C.
What is the InChIKey of 2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole?
The InChIKey is GBPDZTRNRCCJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2.C12H15N.2C11H17N3.2C11H18N2O2.C9H16N2.C8H14N2.C8H13NO.3C7H12N2.C7H11NO.C7H11N.C7H10O.C6H10N2O.2C6H10N2.2C6H9NO.C5H9N3/c1-5-10(15)7-16-11-6-9(4)13-12(14-11)8(2)3;1-9(2)10-4-5-11-7-13(3)8-12(11)6-10;1-9(2)10-4-5-12-11(13-10)8-14-6-3-7-14;1-9(2)11-7-12-6-10(13-11)8-14-4-3-5-14;1-4-9(14)7-15-11-6-12-5-10(13-11)8(2)3;1-4-9(14)7-15-11-12-6-5-10(13-11)8(2)3;1-6(2)9-7(3)10-11(5)8(9)4;1-6(2)8-5-7(3)9-10(8)4;1-5(2)8-6(3)7(4)9-10-8;1-6(2)7-4-8-9(3)5-7;1-6(2)7-4-5-9(3)8-7;1-6(2)7-4-5-8-9(7)3;1-5(2)7-4-6(3)9-8-7;2*1-6(2)7-4-3-5-8-7;1-4(2)6-8-7-5(3)9-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-4(2)5-6-3-7-8-5/h6,8,10,15H,5,7H2,1-4H3;4-9H,1-3H3;4-5,9H,3,6-8H2,1-2H3;6-7,9H,3-5,8H2,1-2H3;2*5-6,8-9,14H,4,7H2,1-3H3;6H,1-5H3;5-6H,1-4H3;5H,1-4H3;3*4-6H,1-3H3;4-5H,1-3H3;3-6,8H,1-2H3;3-6H,1-2H3;4H,1-3H3;2*3-5H,1-2H3,(H,7,8);2*3-5H,1-2H3;3-4H,1-2H3,(H,6,7,8).
What are the key properties of 2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole?
2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole has a molecular weight of 3027.30 g/mol, XLogP of 39.27, 37 rotatable bonds, 7 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2-methyl-5-propan-2-ylisoindole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;2-propan-2-yl-1H-pyrrole;5-propan-2-yl-1H-1,2,4-triazole;1,3,5-trimethyl-4-propan-2-ylpyrazole is sourced from PubChem (CID 158206831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).