2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole

C178H286F3N33O4S16 — CID 159733010

IUPAC2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole
SMILESCC(C)c1ccn(C)n1.CC(C)c1ccnn1C.CC(C)c1cnn(C)c1.CC(C)c1csc(C(C)C)n1.CC(C)c1cscn1.CC(C)c1nc(C(F)(F)F)cs1.CC(C)c1nc(CN2CCCC2)cs1.CC(C)c1nc(N2CCCC2)cs1.CC(C)c1ncc(CN2CCCC2)s1.CC(C)c1ncc(CN2CCOCC2)s1.CC(C)c1ncc(N2CCCC2)s1.CC(C)c1ncc(N2CCOCC2)s1.CC(C)c1nccn1C.CC(C)c1ncco1.CC(C)c1nccs1.COCCn1cc(C(C)C)cn1.Cc1cnc(C(C)C)s1.Cc1csc(C(C)C)n1.Cc1nc(C(C)C)c(C)s1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)sc1C.Cc1scnc1C(C)C
InChIInChI=1S/C11H18N2OS.2C11H18N2S.C10H16N2OS.2C10H16N2S.C9H16N2O.C9H15NS.2C8H13NS.C7H8F3NS.4C7H12N2.4C7H11NS.C6H9NO.2C6H9NS/c1-9(2)11-12-7-10(15-11)8-13-3-5-14-6-4-13;1-9(2)11-12-10(8-14-11)7-13-5-3-4-6-13;1-9(2)11-12-7-10(14-11)8-13-5-3-4-6-13;1-8(2)10-11-7-9(14-10)12-3-5-13-6-4-12;1-8(2)10-11-9(7-13-10)12-5-3-4-6-12;1-8(2)10-11-7-9(13-10)12-5-3-4-6-12;1-8(2)9-6-10-11(7-9)4-5-12-3;1-6(2)8-5-11-9(10-8)7(3)4;1-5(2)8-6(3)10-7(4)9-8;1-5(2)8-9-6(3)7(4)10-8;1-4(2)6-11-5(3-12-6)7(8,9)10;1-6(2)7-4-8-9(3)5-7;1-6(2)7-8-4-5-9(7)3;1-6(2)7-4-5-9(3)8-7;1-6(2)7-4-5-8-9(7)3;1-5(2)7-6(3)9-4-8-7;1-5(2)7-4-9-6(3)8-7;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;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6/h7,9H,3-6,8H2,1-2H3;8-9H,3-7H2,1-2H3;7,9H,3-6,8H2,1-2H3;7-8H,3-6H2,1-2H3;2*7-8H,3-6H2,1-2H3;6-8H,4-5H2,1-3H3;5-7H,1-4H3;2*5H,1-4H3;3-4H,1-2H3;4*4-6H,1-3H3;4*4-5H,1-3H3;3*3-5H,1-2H3
InChIKeyNBLZRVHUKLZJTD-UHFFFAOYSA-N
MW3522.54 g/mol
LogP52.56
Rot. Bonds35

About 2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole

2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole (PubChem CID 159733010) has the molecular formula C178H286F3N33O4S16 and a molecular weight of 3522.54 g/mol. Its IUPAC name is 2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole.

Molecular Properties

Compound Name2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole
PubChem CID159733010
Molecular FormulaC178H286F3N33O4S16
Molecular Weight3522.54 g/mol
Exact Mass3518.87
IUPAC Name2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole
SMILESCC(C)c1ccn(C)n1.CC(C)c1ccnn1C.CC(C)c1cnn(C)c1.CC(C)c1csc(C(C)C)n1.CC(C)c1cscn1.CC(C)c1nc(C(F)(F)F)cs1.CC(C)c1nc(CN2CCCC2)cs1.CC(C)c1nc(N2CCCC2)cs1.CC(C)c1ncc(CN2CCCC2)s1.CC(C)c1ncc(CN2CCOCC2)s1.CC(C)c1ncc(N2CCCC2)s1.CC(C)c1ncc(N2CCOCC2)s1.CC(C)c1nccn1C.CC(C)c1ncco1.CC(C)c1nccs1.COCCn1cc(C(C)C)cn1.Cc1cnc(C(C)C)s1.Cc1csc(C(C)C)n1.Cc1nc(C(C)C)c(C)s1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)sc1C.Cc1scnc1C(C)C
InChIInChI=1S/C11H18N2OS.2C11H18N2S.C10H16N2OS.2C10H16N2S.C9H16N2O.C9H15NS.2C8H13NS.C7H8F3NS.4C7H12N2.4C7H11NS.C6H9NO.2C6H9NS/c1-9(2)11-12-7-10(15-11)8-13-3-5-14-6-4-13;1-9(2)11-12-10(8-14-11)7-13-5-3-4-6-13;1-9(2)11-12-7-10(14-11)8-13-5-3-4-6-13;1-8(2)10-11-7-9(14-10)12-3-5-13-6-4-12;1-8(2)10-11-9(7-13-10)12-5-3-4-6-12;1-8(2)10-11-7-9(13-10)12-5-3-4-6-12;1-8(2)9-6-10-11(7-9)4-5-12-3;1-6(2)8-5-11-9(10-8)7(3)4;1-5(2)8-6(3)10-7(4)9-8;1-5(2)8-9-6(3)7(4)10-8;1-4(2)6-11-5(3-12-6)7(8,9)10;1-6(2)7-4-8-9(3)5-7;1-6(2)7-8-4-5-9(7)3;1-6(2)7-4-5-9(3)8-7;1-6(2)7-4-5-8-9(7)3;1-5(2)7-6(3)9-4-8-7;1-5(2)7-4-9-6(3)8-7;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;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6/h7,9H,3-6,8H2,1-2H3;8-9H,3-7H2,1-2H3;7,9H,3-6,8H2,1-2H3;7-8H,3-6H2,1-2H3;2*7-8H,3-6H2,1-2H3;6-8H,4-5H2,1-3H3;5-7H,1-4H3;2*5H,1-4H3;3-4H,1-2H3;4*4-6H,1-3H3;4*4-5H,1-3H3;3*3-5H,1-2H3
InChIKeyNBLZRVHUKLZJTD-UHFFFAOYSA-N
XLogP52.56
TPSA368.50 Ų
H-Bond Donors
H-Bond Acceptors53
Rotatable Bonds35
Heavy Atoms234
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003522.54
LogP ≤ 552.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1053

Analyze 2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole with MolForge

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Launch Full Analysis

Related Compounds

4-(1,1-Difluoroethyl)-2-propan-2-yl-1,3-thiazole;2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-methyl-2-propan-2-ylpyrrole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;5-(piperidin-1-ylmethyl)-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine
CID 157670881
2,5-Dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole
CID 158116052
N,N-dimethyl-2-(4-propan-2-ylpyrazol-1-yl)ethanamine;2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole
CID 161155018
CID 161450057
CID 161450057
Ethane;methane;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;1-methyl-4-propan-2-ylpyrazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;1-propan-2-ylimidazole;5-propan-2-yl-1,3-oxazole;4-propan-2-ylpyridine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;1-propan-2-yl-1,2,4-triazole
CID 157226919
1,2-Dimethyl-5-propan-2-ylimidazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-5-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;1-ethyl-5-propan-2-ylpyrazole;2-fluoro-5-propan-2-ylthiophene;1-methyl-5-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1-propylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-methyl-2-propan-2-ylpyrrole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;3-methyl-2-propan-2-ylthiophene;1-propan-2-ylcyclopentene;5-propan-2-yl-2,3-dihydrofuran;2-propan-2-yl-1,3-oxazole;2-propan-2-yloxolane;3-propan-2-yloxolane;5-propan-2-yl-1,2-thiazole
CID 157604179
5-tert-butylcyclohex-2-en-1-one;1-tert-butyl-2-ethynylimidazole;4-tert-butyl-2-ethynyl-1,3-oxazole;5-tert-butyl-2-ethynyl-1,3-oxazole;1-tert-butyl-3-ethynylpyrazole;4-tert-butyl-2-ethynyl-1,3-thiazole;4-tert-butyl-3-ethynyl-1,2-thiazole;5-tert-butyl-2-ethynyl-1,3-thiazole;5-tert-butyl-3-ethynyl-1,2-thiazole;1-(3-tert-butylpyrrolidin-1-yl)prop-2-en-1-one;1-tert-butyl-2H-pyrrol-5-one
CID 157973166
Ethane;methane;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole
CID 158012539
N,2-dimethyl-N-[(1-methylimidazol-2-yl)methyl]propanamide;N,2-dimethyl-N-[(2-methylpyrazol-3-yl)methyl]propanamide;N,2-dimethyl-N-(1,3-thiazol-2-ylmethyl)propanamide;N,2-dimethyl-N-(1,3-thiazol-2-yl)propanamide;1-methyl-2-(2-methylpropyl)imidazole;2-(2-methylpropyl)-1,3-oxazole;2-(2-methylpropyl)pyrimidine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole
CID 158657566
1-Methylimidazole;2-methyl-1,3,4-oxadiazole;3-methyl-1,2,4-oxadiazole;2-methyl-1,3-oxazole;1-methylpyrazole;2-methylpyridine;3-methylpyridine;1-methylpyrrole;2-methyl-1,3,4-thiadiazole;2-methyl-1,3-thiazole;1-methyltriazole;1-methyl-1,2,4-triazole
CID 159728061
5-tert-butylcyclohex-2-en-1-one;6-tert-butylcyclohex-2-en-1-one;1-tert-butyl-2-ethenylimidazole;1-tert-butyl-2-ethynylimidazole;4-tert-butyl-2-ethynyl-1,3-oxazole;5-tert-butyl-2-ethynyl-1,3-oxazole;1-tert-butyl-3-ethynylpyrazole;4-tert-butyl-2-ethynyl-1,3-thiazole;4-tert-butyl-3-ethynyl-1,2-thiazole;5-tert-butyl-2-ethynyl-1,3-thiazole;5-tert-butyl-3-ethynyl-1,2-thiazole;1-tert-butyl-3-methylpyrazole;1-(3-tert-butylpyrrolidin-1-yl)prop-2-en-1-one;1-tert-butyl-2H-pyrrol-5-one
CID 159772871
Ethane;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;1-methyl-4-propan-2-ylpyrazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;1-propan-2-ylimidazole;5-propan-2-yl-1,3-oxazole;4-propan-2-ylpyridine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;1-propan-2-yl-1,2,4-triazole
CID 159885156

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole?
The IUPAC name of 2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole (CID 159733010) is 2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole.
What is the SMILES notation for 2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole?
The canonical SMILES for 2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole is CC(C)c1ccn(C)n1.CC(C)c1ccnn1C.CC(C)c1cnn(C)c1.CC(C)c1csc(C(C)C)n1.CC(C)c1cscn1.CC(C)c1nc(C(F)(F)F)cs1.CC(C)c1nc(CN2CCCC2)cs1.CC(C)c1nc(N2CCCC2)cs1.CC(C)c1ncc(CN2CCCC2)s1.CC(C)c1ncc(CN2CCOCC2)s1.CC(C)c1ncc(N2CCCC2)s1.CC(C)c1ncc(N2CCOCC2)s1.CC(C)c1nccn1C.CC(C)c1ncco1.CC(C)c1nccs1.COCCn1cc(C(C)C)cn1.Cc1cnc(C(C)C)s1.Cc1csc(C(C)C)n1.Cc1nc(C(C)C)c(C)s1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)sc1C.Cc1scnc1C(C)C.
What is the InChIKey of 2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole?
The InChIKey is NBLZRVHUKLZJTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS.2C11H18N2S.C10H16N2OS.2C10H16N2S.C9H16N2O.C9H15NS.2C8H13NS.C7H8F3NS.4C7H12N2.4C7H11NS.C6H9NO.2C6H9NS/c1-9(2)11-12-7-10(15-11)8-13-3-5-14-6-4-13;1-9(2)11-12-10(8-14-11)7-13-5-3-4-6-13;1-9(2)11-12-7-10(14-11)8-13-5-3-4-6-13;1-8(2)10-11-7-9(14-10)12-3-5-13-6-4-12;1-8(2)10-11-9(7-13-10)12-5-3-4-6-12;1-8(2)10-11-7-9(13-10)12-5-3-4-6-12;1-8(2)9-6-10-11(7-9)4-5-12-3;1-6(2)8-5-11-9(10-8)7(3)4;1-5(2)8-6(3)10-7(4)9-8;1-5(2)8-9-6(3)7(4)10-8;1-4(2)6-11-5(3-12-6)7(8,9)10;1-6(2)7-4-8-9(3)5-7;1-6(2)7-8-4-5-9(7)3;1-6(2)7-4-5-9(3)8-7;1-6(2)7-4-5-8-9(7)3;1-5(2)7-6(3)9-4-8-7;1-5(2)7-4-9-6(3)8-7;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;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6/h7,9H,3-6,8H2,1-2H3;8-9H,3-7H2,1-2H3;7,9H,3-6,8H2,1-2H3;7-8H,3-6H2,1-2H3;2*7-8H,3-6H2,1-2H3;6-8H,4-5H2,1-3H3;5-7H,1-4H3;2*5H,1-4H3;3-4H,1-2H3;4*4-6H,1-3H3;4*4-5H,1-3H3;3*3-5H,1-2H3.
What are the key properties of 2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole?
2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole has a molecular weight of 3522.54 g/mol, XLogP of 52.56, 35 rotatable bonds, 0 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;2,4-di(propan-2-yl)-1,3-thiazole;1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-methyl-2-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)-1,3-thiazole;2-propan-2-yl-4-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-5-pyrrolidin-1-yl-1,3-thiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;4-[(2-propan-2-yl-1,3-thiazol-5-yl)methyl]morpholine;4-(2-propan-2-yl-1,3-thiazol-5-yl)morpholine;2-propan-2-yl-4-(trifluoromethyl)-1,3-thiazole is sourced from PubChem (CID 159733010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).