2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole

C237H346F4N32O5S3 — CID 160747023

IUPAC2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole
SMILESCC(C)c1ccc(CN2CCCCC2)nc1.CC(C)c1ccc(F)cn1.CC(C)c1cccc(CN2CCCCC2)n1.CC(C)c1cccc(N2CCCC2)n1.CC(C)c1cccc(N2CCOCC2)n1.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1cccnn1.CC(C)c1ccnc(N2CCC2)c1.CC(C)c1ccnc(N2CCCC2)c1.CC(C)c1ccncc1F.CC(C)c1cncnc1.CC(C)c1ncc(F)cc1F.CC(C)c1nccs1.CC[C@@H](O)COc1cccc(C(C)C)n1.CC[C@H](O)COc1cccc(C(C)C)n1.Cc1cc(C(C)C)cc(C)n1.Cc1cc(C)nc(C(C)C)c1.Cc1ccc(C(C)C)cn1.Cc1ccnc(C(C)C)c1.Cc1cnc(C(C)C)s1.Cc1cncc(C(C)C)c1.Cc1csc(C(C)C)n1
InChIInChI=1S/2C14H22N2.C12H18N2O.2C12H18N2.2C12H19NO2.C11H16N2.2C10H15N.3C9H13N.C9H12.C8H9F2N.2C8H10FN.3C8H11N.2C7H10N2.2C7H11NS.C6H9NS/c1-12(2)14-8-6-7-13(15-14)11-16-9-4-3-5-10-16;1-12(2)13-6-7-14(15-10-13)11-16-8-4-3-5-9-16;1-10(2)11-4-3-5-12(13-11)14-6-8-15-9-7-14;1-10(2)11-6-5-7-12(13-11)14-8-3-4-9-14;1-10(2)11-5-6-13-12(9-11)14-7-3-4-8-14;2*1-4-10(14)8-15-12-7-5-6-11(13-12)9(2)3;1-9(2)10-4-5-12-11(8-10)13-6-3-7-13;1-7(2)10-5-8(3)11-9(4)6-10;1-7(2)10-6-8(3)5-9(4)11-10;1-7(2)9-4-8(3)5-10-6-9;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-6-8(3)4-5-10-9;1-8(2)9-6-4-3-5-7-9;1-5(2)8-7(10)3-6(9)4-11-8;1-6(2)7-3-4-10-5-8(7)9;1-6(2)8-4-3-7(9)5-10-8;1-7(2)8-4-3-5-9-6-8;2*1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-4-3-5-8-9-7;1-5(2)7-8-6(3)4-9-7;1-5(2)7-8-4-6(3)9-7;1-5(2)6-7-3-4-8-6/h6-8,12H,3-5,9-11H2,1-2H3;6-7,10,12H,3-5,8-9,11H2,1-2H3;3-5,10H,6-9H2,1-2H3;5-7,10H,3-4,8-9H2,1-2H3;5-6,9-10H,3-4,7-8H2,1-2H3;2*5-7,9-10,14H,4,8H2,1-3H3;4-5,8-9H,3,6-7H2,1-2H3;2*5-7H,1-4H3;3*4-7H,1-3H3;3-8H,1-2H3;3-5H,1-2H3;2*3-6H,1-2H3;3*3-7H,1-2H3;2*3-6H,1-2H3;2*4-5H,1-3H3;3-5H,1-2H3/t;;;;;2*10-;;;;;;;;;;;;;;;;;;/m.....10................../s1
InChIKeyRWHYFIIZMOPSCL-HWIUMEDNSA-N
MW3895.79 g/mol
LogP61.55
Rot. Bonds41

About 2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole

2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole (PubChem CID 160747023) has the molecular formula C237H346F4N32O5S3 and a molecular weight of 3895.79 g/mol. Its IUPAC name is 2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole.

Molecular Properties

Compound Name2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole
PubChem CID160747023
Molecular FormulaC237H346F4N32O5S3
Molecular Weight3895.79 g/mol
Exact Mass3892.69
IUPAC Name2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole
SMILESCC(C)c1ccc(CN2CCCCC2)nc1.CC(C)c1ccc(F)cn1.CC(C)c1cccc(CN2CCCCC2)n1.CC(C)c1cccc(N2CCCC2)n1.CC(C)c1cccc(N2CCOCC2)n1.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1cccnn1.CC(C)c1ccnc(N2CCC2)c1.CC(C)c1ccnc(N2CCCC2)c1.CC(C)c1ccncc1F.CC(C)c1cncnc1.CC(C)c1ncc(F)cc1F.CC(C)c1nccs1.CC[C@@H](O)COc1cccc(C(C)C)n1.CC[C@H](O)COc1cccc(C(C)C)n1.Cc1cc(C(C)C)cc(C)n1.Cc1cc(C)nc(C(C)C)c1.Cc1ccc(C(C)C)cn1.Cc1ccnc(C(C)C)c1.Cc1cnc(C(C)C)s1.Cc1cncc(C(C)C)c1.Cc1csc(C(C)C)n1
InChIInChI=1S/2C14H22N2.C12H18N2O.2C12H18N2.2C12H19NO2.C11H16N2.2C10H15N.3C9H13N.C9H12.C8H9F2N.2C8H10FN.3C8H11N.2C7H10N2.2C7H11NS.C6H9NS/c1-12(2)14-8-6-7-13(15-14)11-16-9-4-3-5-10-16;1-12(2)13-6-7-14(15-10-13)11-16-8-4-3-5-9-16;1-10(2)11-4-3-5-12(13-11)14-6-8-15-9-7-14;1-10(2)11-6-5-7-12(13-11)14-8-3-4-9-14;1-10(2)11-5-6-13-12(9-11)14-7-3-4-8-14;2*1-4-10(14)8-15-12-7-5-6-11(13-12)9(2)3;1-9(2)10-4-5-12-11(8-10)13-6-3-7-13;1-7(2)10-5-8(3)11-9(4)6-10;1-7(2)10-6-8(3)5-9(4)11-10;1-7(2)9-4-8(3)5-10-6-9;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-6-8(3)4-5-10-9;1-8(2)9-6-4-3-5-7-9;1-5(2)8-7(10)3-6(9)4-11-8;1-6(2)7-3-4-10-5-8(7)9;1-6(2)8-4-3-7(9)5-10-8;1-7(2)8-4-3-5-9-6-8;2*1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-4-3-5-8-9-7;1-5(2)7-8-6(3)4-9-7;1-5(2)7-8-4-6(3)9-7;1-5(2)6-7-3-4-8-6/h6-8,12H,3-5,9-11H2,1-2H3;6-7,10,12H,3-5,8-9,11H2,1-2H3;3-5,10H,6-9H2,1-2H3;5-7,10H,3-4,8-9H2,1-2H3;5-6,9-10H,3-4,7-8H2,1-2H3;2*5-7,9-10,14H,4,8H2,1-3H3;4-5,8-9H,3,6-7H2,1-2H3;2*5-7H,1-4H3;3*4-7H,1-3H3;3-8H,1-2H3;3-5H,1-2H3;2*3-6H,1-2H3;3*3-7H,1-2H3;2*3-6H,1-2H3;2*4-5H,1-3H3;3-5H,1-2H3/t;;;;;2*10-;;;;;;;;;;;;;;;;;;/m.....10................../s1
InChIKeyRWHYFIIZMOPSCL-HWIUMEDNSA-N
XLogP61.55
TPSA422.73 Ų
H-Bond Donors2
H-Bond Acceptors40
Rotatable Bonds41
Heavy Atoms281
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003895.79
LogP ≤ 561.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1040

Analyze 2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole with MolForge

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Launch Full Analysis

Related Compounds

CID 159884607
CID 159884607
Cumene;2-(1,1-difluoroethyl)-5-propan-2-yl-1,3-thiazole;4-(difluoromethyl)-2-propan-2-ylpyrimidine;2,4-difluoro-1-propan-2-ylbenzene;1-(2,2-difluoropropyl)-3-propan-2-ylpyrazole;2,5-dimethyl-2-methylsulfonylhex-3-yne;2-ethoxy-5-propan-2-ylpyridine;5-ethoxy-2-propan-2-ylpyrimidine;5-ethyl-2-propan-2-ylpyrimidine;5-fluoro-2-propan-2-ylpyrimidine;2-methoxy-2,5-dimethylhexane;2-methoxy-2,5-dimethylhex-3-yne;2-methoxy-5-propan-2-ylpyrazine;2-methoxy-6-propan-2-ylpyrazine;4-methyl-2-propan-2-ylpyrimidine;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;2-methylsulfonyl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrimidine;2-(4-propan-2-yl-1,3-thiazol-2-yl)propan-2-ol;2-(5-propan-2-yl-1,3-thiazol-2-yl)propan-2-ol;5-propan-2-yl-2-(trifluoromethyl)pyridine;2-propan-2-yl-4-(trifluoromethyl)pyrimidine
CID 167665522
3-(azetidin-1-yl)-5-propan-2-ylpyridine;3-cyclopropyl-5-propan-2-ylpyridine;2-methyl-1-[(3-methyl-5-propan-2-yl-2-pyridinyl)oxy]propan-2-ol;1-methyl-6-propan-2-ylimidazo[4,5-b]pyridine;3-methyl-6-propan-2-ylimidazo[4,5-b]pyridine;1-methyl-4-(5-propan-2-yl-3-pyridinyl)piperazine;3-(1-methylpyrazol-3-yl)-5-propan-2-ylpyridine;3-(1-methylpyrazol-4-yl)-5-propan-2-ylpyridine;6-propan-2-yl-3,4-dihydro-2H-pyrano[3,2-b]pyridine;2-propan-2-yl-1,8-naphthyridine;3-propan-2-yl-5-pyrazol-1-ylpyridine;(5-propan-2-yl-3-pyridinyl)methanol;2-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole;5-(5-propan-2-yl-3-pyridinyl)-1,3-thiazole;3-propan-2-ylquinoline;6-propan-2-yl-[1,3]thiazolo[4,5-b]pyridine;3-propan-2-yl-5-(triazol-1-yl)pyridine;3-propan-2-yl-5-(triazol-2-yl)pyridine
CID 157550216
2-(azetidin-1-yl)-6-propan-2-ylpyridine;3,5-difluoro-2-propan-2-ylpyridine;1,3-dimethyl-5-propan-2-ylpyrazole;2,4-dimethyl-6-propan-2-ylpyridine;2,5-dimethyl-4-propan-2-yl-1,3-thiazole;3-fluoro-2-propan-2-ylpyridine;1-methyl-4-propan-2-ylimidazole;2-methyl-5-propan-2-ylpyrazine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(oxan-4-yl)-4-propan-2-ylpyridine;5-propan-2-yl-1H-pyrazin-2-one;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;4-[(6-propan-2-yl-2-pyridinyl)methyl]morpholine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-3-[(6-propan-2-yl-2-pyridinyl)oxy]propane-1,2-diol;(2S)-3-[(6-propan-2-yl-2-pyridinyl)oxy]propane-1,2-diol;2-propan-2-ylpyrimidine;bis(4-propan-2-ylpyrimidine);2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole
CID 157803891
Methane;1-methyl-4-propan-2-ylbenzene;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-(piperidin-1-ylmethyl)-2-propan-2-yl-1,3-thiazole;1-(3-propan-2-ylphenoxy)butan-2-ol;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-[(4-propan-2-ylphenyl)methyl]morpholine;1-[(3-propan-2-ylphenyl)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]pyrrolidine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);4-[(6-propan-2-yl-2-pyridinyl)methyl]morpholine;2-propan-2-ylpyrimidine;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)pyridine;2-propan-2-yl-6-(pyrrolidin-1-ylmethyl)pyridine;2-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]morpholine
CID 157838409
CID 158153588
CID 158153588
2-(azetidin-1-yl)-4-propan-2-ylpyridine;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;3-fluoro-5-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;3-propan-2-ylpyridazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;4-[(5-propan-2-yl-2-pyridinyl)methyl]morpholine;4-[(6-propan-2-yl-2-pyridinyl)methyl]morpholine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole
CID 158179720
4-(Azetidin-1-ylmethyl)-2-propan-2-yl-1,3-thiazole;5-(azetidin-1-ylmethyl)-2-propan-2-yl-1,3-thiazole;cumene;methane;1-methyl-4-propan-2-ylbenzene;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;4-methyl-2-propan-2-yl-1,3-thiazole;bis(5-methyl-2-propan-2-yl-1,3-thiazole);1-(3-propan-2-ylphenoxy)butan-2-ol;1-(4-propan-2-ylphenoxy)butan-2-ol;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-[(4-propan-2-ylphenyl)methyl]morpholine;1-[(3-propan-2-ylphenyl)methyl]pyrrolidine;1-[(4-propan-2-ylphenyl)methyl]pyrrolidine;4-(3-propan-2-ylphenyl)morpholine;1-(3-propan-2-ylphenyl)pyrrolidine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-yl-1,3,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,2-thiazole;4-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]morpholine;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine
CID 158249162
2-(azetidin-1-yl)-6-propan-2-ylpyridine;1,3-dimethyl-5-propan-2-ylpyrazole;methane;2-methyl-5-propan-2-ylpyrazine;2-methyl-3-[(4-propan-2-yl-2-pyridinyl)oxy]propan-1-ol;3-methyl-5-propan-2-yl-1,2-thiazole;3-(3-propan-2-ylphenyl)pyrrolidine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;2-propan-2-yl-6-(pyrrolidin-1-ylmethyl)pyridine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-1,3-thiazole
CID 158258179
2-[4-[(3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]pyrrol-4-yl]-6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-2-yl]oxyethanol;(3aR,6aR)-4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyrimidin-4-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]pyrrole;(3aR,6aR)-4-[6-(3-phenylpyrazol-1-yl)-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]pyrrole
CID 158630737
4-[4-[(3aR,6aR)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]pyrrol-4-yl]-6-[3-(3-methoxyphenyl)pyrazol-1-yl]pyrimidin-2-yl]oxybutane-1,2-diol;4-[6-[3-(3-methoxyphenyl)pyrazol-1-yl]-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyrimidin-4-yl]morpholine;4-[4-[3-(3-methoxyphenyl)pyrazol-1-yl]-6-morpholin-4-ylpyrimidin-2-yl]oxybutane-1,2-diol
CID 158985512
cumene;2,4-dimethyl-6-propan-2-ylpyridine;methane;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;bis(5-methyl-2-propan-2-yl-1,3-thiazole);2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-4-propan-2-ylpyrimidine;5-(piperidin-1-ylmethyl)-2-propan-2-yl-1,3-thiazole;1-(3-propan-2-ylphenoxy)butan-2-ol;1-(4-propan-2-ylphenoxy)butan-2-ol;2-propan-2-ylpyrazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;1-[(4-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;2-propan-2-ylpyrimidine;5-propan-2-yl-3H-pyrrole;2-propan-2-yl-1,3,4-thiadiazole;2-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]morpholine;2-propan-2-ylthiophene
CID 159346038

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole?
The IUPAC name of 2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole (CID 160747023) is 2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole.
What is the SMILES notation for 2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole?
The canonical SMILES for 2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole is CC(C)c1ccc(CN2CCCCC2)nc1.CC(C)c1ccc(F)cn1.CC(C)c1cccc(CN2CCCCC2)n1.CC(C)c1cccc(N2CCCC2)n1.CC(C)c1cccc(N2CCOCC2)n1.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1cccnn1.CC(C)c1ccnc(N2CCC2)c1.CC(C)c1ccnc(N2CCCC2)c1.CC(C)c1ccncc1F.CC(C)c1cncnc1.CC(C)c1ncc(F)cc1F.CC(C)c1nccs1.CC[C@@H](O)COc1cccc(C(C)C)n1.CC[C@H](O)COc1cccc(C(C)C)n1.Cc1cc(C(C)C)cc(C)n1.Cc1cc(C)nc(C(C)C)c1.Cc1ccc(C(C)C)cn1.Cc1ccnc(C(C)C)c1.Cc1cnc(C(C)C)s1.Cc1cncc(C(C)C)c1.Cc1csc(C(C)C)n1.
What is the InChIKey of 2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole?
The InChIKey is RWHYFIIZMOPSCL-HWIUMEDNSA-N. The full InChI is InChI=1S/2C14H22N2.C12H18N2O.2C12H18N2.2C12H19NO2.C11H16N2.2C10H15N.3C9H13N.C9H12.C8H9F2N.2C8H10FN.3C8H11N.2C7H10N2.2C7H11NS.C6H9NS/c1-12(2)14-8-6-7-13(15-14)11-16-9-4-3-5-10-16;1-12(2)13-6-7-14(15-10-13)11-16-8-4-3-5-9-16;1-10(2)11-4-3-5-12(13-11)14-6-8-15-9-7-14;1-10(2)11-6-5-7-12(13-11)14-8-3-4-9-14;1-10(2)11-5-6-13-12(9-11)14-7-3-4-8-14;2*1-4-10(14)8-15-12-7-5-6-11(13-12)9(2)3;1-9(2)10-4-5-12-11(8-10)13-6-3-7-13;1-7(2)10-5-8(3)11-9(4)6-10;1-7(2)10-6-8(3)5-9(4)11-10;1-7(2)9-4-8(3)5-10-6-9;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-6-8(3)4-5-10-9;1-8(2)9-6-4-3-5-7-9;1-5(2)8-7(10)3-6(9)4-11-8;1-6(2)7-3-4-10-5-8(7)9;1-6(2)8-4-3-7(9)5-10-8;1-7(2)8-4-3-5-9-6-8;2*1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-6(2)7-4-3-5-8-9-7;1-5(2)7-8-6(3)4-9-7;1-5(2)7-8-4-6(3)9-7;1-5(2)6-7-3-4-8-6/h6-8,12H,3-5,9-11H2,1-2H3;6-7,10,12H,3-5,8-9,11H2,1-2H3;3-5,10H,6-9H2,1-2H3;5-7,10H,3-4,8-9H2,1-2H3;5-6,9-10H,3-4,7-8H2,1-2H3;2*5-7,9-10,14H,4,8H2,1-3H3;4-5,8-9H,3,6-7H2,1-2H3;2*5-7H,1-4H3;3*4-7H,1-3H3;3-8H,1-2H3;3-5H,1-2H3;2*3-6H,1-2H3;3*3-7H,1-2H3;2*3-6H,1-2H3;2*4-5H,1-3H3;3-5H,1-2H3/t;;;;;2*10-;;;;;;;;;;;;;;;;;;/m.....10................../s1.
What are the key properties of 2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole?
2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole has a molecular weight of 3895.79 g/mol, XLogP of 61.55, 41 rotatable bonds, 2 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-1-yl)-4-propan-2-ylpyridine;cumene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-(piperidin-1-ylmethyl)-5-propan-2-ylpyridine;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyridine;3-propan-2-ylpyridazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-(6-propan-2-yl-2-pyridinyl)morpholine;(2R)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;5-propan-2-ylpyrimidine;2-propan-2-yl-6-pyrrolidin-1-ylpyridine;4-propan-2-yl-2-pyrrolidin-1-ylpyridine;2-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 160747023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).