3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine

C189H291F3N42O25 — CID 157227881

IUPAC3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine
SMILESCC(C)Oc1ccc(C(C)C)nn1.CC(C)c1c[nH]c(=O)cn1.CC(C)c1cc(N(C)C)cnn1.CC(C)c1cc(OCC(O)COC(C)(C)C)cnn1.CC(C)c1cccnn1.CC(C)c1cncc(N2CCOCC2)n1.CC(C)c1cncc(OCC(O)CO)n1.CC(C)c1cncc(OC[C@@H](O)CO)n1.CC(C)c1cncc(OC[C@H](O)CO)n1.CC(C)c1cnccn1.CC(C)c1nccc(OCC(F)(F)F)n1.CC(C)c1nccc(OCC(O)CO)n1.CC(C)c1nccc(OCC2(C)COC2)n1.CCOc1ccc(C(C)C)nn1.COc1ccc(C(C)C)nn1.Cc1cc(OCC2(C)COC2)nc(C(C)C)n1.Cc1ccc(C(C)C)nn1.Cc1ccnnc1C(C)C.Cc1cnc(C(C)C)c(C)n1.Cc1cnc(C(C)C)cn1
InChIInChI=1S/C14H24N2O3.C13H20N2O2.C12H18N2O2.C11H17N3O.4C10H16N2O3.C10H16N2O.C9H11F3N2O.C9H15N3.C9H14N2O.C9H14N2.C8H12N2O.3C8H12N2.C7H10N2O.2C7H10N2/c1-10(2)13-6-12(7-15-16-13)18-8-11(17)9-19-14(3,4)5;1-9(2)12-14-10(3)5-11(15-12)17-8-13(4)6-16-7-13;1-9(2)11-13-5-4-10(14-11)16-8-12(3)6-15-7-12;1-9(2)10-7-12-8-11(13-10)14-3-5-15-6-4-14;3*1-7(2)9-3-11-4-10(12-9)15-6-8(14)5-13;1-7(2)10-11-4-3-9(12-10)15-6-8(14)5-13;1-7(2)9-5-6-10(12-11-9)13-8(3)4;1-6(2)8-13-4-3-7(14-8)15-5-9(10,11)12;1-7(2)9-5-8(12(3)4)6-10-11-9;1-4-12-9-6-5-8(7(2)3)10-11-9;1-6(2)9-8(4)11-7(3)5-10-9;1-6(2)7-4-5-8(11-3)10-9-7;1-6(2)8-5-9-7(3)4-10-8;1-6(2)8-7(3)4-5-9-10-8;1-6(2)8-5-4-7(3)9-10-8;1-5(2)6-3-9-7(10)4-8-6;1-6(2)7-5-8-3-4-9-7;1-6(2)7-4-3-5-8-9-7/h6-7,10-11,17H,8-9H2,1-5H3;5,9H,6-8H2,1-4H3;4-5,9H,6-8H2,1-3H3;7-9H,3-6H2,1-2H3;4*3-4,7-8,13-14H,5-6H2,1-2H3;5-8H,1-4H3;3-4,6H,5H2,1-2H3;5-7H,1-4H3;5-7H,4H2,1-3H3;5-6H,1-4H3;4-6H,1-3H3;3*4-6H,1-3H3;3-5H,1-2H3,(H,9,10);2*3-6H,1-2H3/t;;;;2*8-;;;;;;;;;;;;;;/m....10............../s1
InChIKeyATTGESFYNFIVJA-PUCGZIASSA-N
MW3608.67 g/mol
LogP31.50
Rot. Bonds56

About 3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine

3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine (PubChem CID 157227881) has the molecular formula C189H291F3N42O25 and a molecular weight of 3608.67 g/mol. Its IUPAC name is 3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine.

Molecular Properties

Compound Name3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine
PubChem CID157227881
Molecular FormulaC189H291F3N42O25
Molecular Weight3608.67 g/mol
Exact Mass3606.27
IUPAC Name3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine
SMILESCC(C)Oc1ccc(C(C)C)nn1.CC(C)c1c[nH]c(=O)cn1.CC(C)c1cc(N(C)C)cnn1.CC(C)c1cc(OCC(O)COC(C)(C)C)cnn1.CC(C)c1cccnn1.CC(C)c1cncc(N2CCOCC2)n1.CC(C)c1cncc(OCC(O)CO)n1.CC(C)c1cncc(OC[C@@H](O)CO)n1.CC(C)c1cncc(OC[C@H](O)CO)n1.CC(C)c1cnccn1.CC(C)c1nccc(OCC(F)(F)F)n1.CC(C)c1nccc(OCC(O)CO)n1.CC(C)c1nccc(OCC2(C)COC2)n1.CCOc1ccc(C(C)C)nn1.COc1ccc(C(C)C)nn1.Cc1cc(OCC2(C)COC2)nc(C(C)C)n1.Cc1ccc(C(C)C)nn1.Cc1ccnnc1C(C)C.Cc1cnc(C(C)C)c(C)n1.Cc1cnc(C(C)C)cn1
InChIInChI=1S/C14H24N2O3.C13H20N2O2.C12H18N2O2.C11H17N3O.4C10H16N2O3.C10H16N2O.C9H11F3N2O.C9H15N3.C9H14N2O.C9H14N2.C8H12N2O.3C8H12N2.C7H10N2O.2C7H10N2/c1-10(2)13-6-12(7-15-16-13)18-8-11(17)9-19-14(3,4)5;1-9(2)12-14-10(3)5-11(15-12)17-8-13(4)6-16-7-13;1-9(2)11-13-5-4-10(14-11)16-8-12(3)6-15-7-12;1-9(2)10-7-12-8-11(13-10)14-3-5-15-6-4-14;3*1-7(2)9-3-11-4-10(12-9)15-6-8(14)5-13;1-7(2)10-11-4-3-9(12-10)15-6-8(14)5-13;1-7(2)9-5-6-10(12-11-9)13-8(3)4;1-6(2)8-13-4-3-7(14-8)15-5-9(10,11)12;1-7(2)9-5-8(12(3)4)6-10-11-9;1-4-12-9-6-5-8(7(2)3)10-11-9;1-6(2)9-8(4)11-7(3)5-10-9;1-6(2)7-4-5-8(11-3)10-9-7;1-6(2)8-5-9-7(3)4-10-8;1-6(2)8-7(3)4-5-9-10-8;1-6(2)8-5-4-7(3)9-10-8;1-5(2)6-3-9-7(10)4-8-6;1-6(2)7-5-8-3-4-9-7;1-6(2)7-4-3-5-8-9-7/h6-7,10-11,17H,8-9H2,1-5H3;5,9H,6-8H2,1-4H3;4-5,9H,6-8H2,1-3H3;7-9H,3-6H2,1-2H3;4*3-4,7-8,13-14H,5-6H2,1-2H3;5-8H,1-4H3;3-4,6H,5H2,1-2H3;5-7H,1-4H3;5-7H,4H2,1-3H3;5-6H,1-4H3;4-6H,1-3H3;3*4-6H,1-3H3;3-5H,1-2H3,(H,9,10);2*3-6H,1-2H3/t;;;;2*8-;;;;;;;;;;;;;;/m....10............../s1
InChIKeyATTGESFYNFIVJA-PUCGZIASSA-N
XLogP31.50
TPSA862.57 Ų
H-Bond Donors10
H-Bond Acceptors66
Rotatable Bonds56
Heavy Atoms259
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003608.67
LogP ≤ 531.50
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1066

Analyze 3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine with MolForge

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Related Compounds

4-(2,2-difluoropropoxy)-2-propan-2-ylpyrimidine;3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;methane;3-methoxy-6-propan-2-ylpyridazine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;(2R)-1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;3-propan-2-ylpyridazine
CID 157409821
4-(2,2-difluoropropoxy)-2-propan-2-ylpyrimidine;4,6-dimethoxy-2-propan-2-ylpyrimidine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-ethoxy-6-propan-2-ylpyridazine;methane;4-methoxy-6-methyl-2-propan-2-ylpyrimidine;3-methoxy-6-propan-2-ylpyridazine;4-methoxy-2-propan-2-ylpyrimidine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;4-methyl-2-propan-2-ylpyrimidine;3-propan-2-yl-6-propan-2-yloxypyridazine;3-propan-2-ylpyridazine;1-(2-propan-2-ylpyrimidin-4-yl)oxybutan-2-ol;2-propan-2-yl-4-pyrrolidin-1-ylpyrimidine
CID 157590896
4-(2,2-difluoropropoxy)-2-propan-2-ylpyrimidine;N,N-dimethyl-2-propan-2-ylpyridin-4-amine;2,6-dimethyl-3-propan-2-ylpyridine;5-ethoxy-2-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-[(2-propan-2-yl-4-pyridinyl)oxy]propan-2-ol;2-methyl-5-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;1-(6-propan-2-ylpyrazin-2-yl)oxybutan-2-ol;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;2-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one
CID 158002540
CID 158217703
CID 158217703
3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane
CID 158278460
CID 158663659
CID 158663659
3-[2,6-Bis(3,6-dipropylpyrazin-2-yl)-4-pyridinyl]-2,5-dipropylpyrazine;2,5-dihexyl-3,6-bis(5-methylpyrimidin-2-yl)pyrazine;[3-(4,6-dimethylpyrimidin-2-yl)-6-(4,6-dipropoxypyrimidin-2-yl)-5-methoxypyridazin-4-yl]methanol;[3-(4,6-dimethylpyrimidin-2-yl)-6-(4,6-dipropoxypyrimidin-2-yl)-5-propylpyrazin-2-yl]methanol;5-(trifluoromethyl)-3-[1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]oxypyridazine;2,4,6-tris(3,6-dipropylpyrazin-2-yl)pyrimidine
CID 159422371
(9S)-N-[6-[(2S)-2,3-dihydroxypropoxy]pyridazin-4-yl]-5-[3-(trifluoromethyl)phenyl]-1,4,6,8-tetrazatricyclo[7.3.1.02,7]trideca-2,4,6-triene-8-carboxamide;(9S)-N-[5-[(2S)-2,3-dihydroxypropoxy]-3-pyridinyl]-3-methyl-5-[3-(trifluoromethyl)phenyl]-1,4,6,8-tetrazatricyclo[7.3.1.02,7]trideca-2,4,6-triene-8-carboxamide
CID 159794708
3-cyclopropyl-6-propan-2-ylpyridazine;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;1,1,1-trifluoro-2-methylpropane
CID 160213104
3-cyclopropyl-6-propan-2-ylpyridazine;2,2-difluoro-3-methylbutane;2,3-dimethylbutan-2-ol;N,2-dimethylpropanamide;2-ethoxypropane;3-ethoxy-6-propan-2-ylpyridazine;2-(2-methoxyethoxy)propane;1-methoxy-3-methylbutane;2-methoxypropane;1-methoxy-2-propan-2-ylcyclobutane;tris(1-methoxy-3-propan-2-yloxycyclobutane);bis(1-methoxy-4-propan-2-yloxycyclohexane);4-methylpentan-1-ol;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;propan-2-ylcyclohexane;bis(4-(4-propan-2-ylcyclohexyl)morpholine);propan-2-ylcyclopropane;propan-2-yloxycyclobutane;propan-2-yloxycyclohexane;propan-2-yloxycyclopropane;2-propan-2-yloxypropane;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;trans-(1S,2R)-1-methoxy-2-propan-2-ylcyclobutane;2-(trideuteriomethoxy)propane;1,1,1-trifluoro-2-methylpropane
CID 160274721
3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;4,6-dimethyl-3-propan-2-ylpyridazine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine
CID 161779377
2-tert-butyl-4-propan-2-ylpyrimidine;2-cyclopropyl-4-propan-2-ylpyrimidine;2-(2,2-difluoropropoxy)-4-propan-2-ylpyridine;2,4-dimethoxy-6-propan-2-ylpyrimidine;2,4-dimethyl-6-propan-2-ylpyrimidine;2,4-di(propan-2-yl)pyrimidine;2-ethoxy-4-propan-2-ylpyridine;2-ethoxy-4-propan-2-ylpyrimidine;methane;2-methoxy-4-propan-2-ylpyrimidine;1-[(6-methyl-4-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2R)-1-[(6-methyl-4-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;(2S)-1-[(6-methyl-4-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;2-methyl-4-propan-2-ylpyrimidine;2-(piperidin-1-ylmethyl)-4-propan-2-ylpyridine;4-propan-2-yl-1H-pyridin-2-one;4-propan-2-ylpyrimidine;4-[(4-propan-2-ylpyrimidin-2-yl)methyl]morpholine;1-(4-propan-2-ylpyrimidin-2-yl)oxybutan-2-ol;4-propan-2-yl-2-(pyrrolidin-1-ylmethyl)pyridine
CID 161781575

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine?
The IUPAC name of 3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine (CID 157227881) is 3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine.
What is the SMILES notation for 3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine?
The canonical SMILES for 3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine is CC(C)Oc1ccc(C(C)C)nn1.CC(C)c1c[nH]c(=O)cn1.CC(C)c1cc(N(C)C)cnn1.CC(C)c1cc(OCC(O)COC(C)(C)C)cnn1.CC(C)c1cccnn1.CC(C)c1cncc(N2CCOCC2)n1.CC(C)c1cncc(OCC(O)CO)n1.CC(C)c1cncc(OC[C@@H](O)CO)n1.CC(C)c1cncc(OC[C@H](O)CO)n1.CC(C)c1cnccn1.CC(C)c1nccc(OCC(F)(F)F)n1.CC(C)c1nccc(OCC(O)CO)n1.CC(C)c1nccc(OCC2(C)COC2)n1.CCOc1ccc(C(C)C)nn1.COc1ccc(C(C)C)nn1.Cc1cc(OCC2(C)COC2)nc(C(C)C)n1.Cc1ccc(C(C)C)nn1.Cc1ccnnc1C(C)C.Cc1cnc(C(C)C)c(C)n1.Cc1cnc(C(C)C)cn1.
What is the InChIKey of 3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine?
The InChIKey is ATTGESFYNFIVJA-PUCGZIASSA-N. The full InChI is InChI=1S/C14H24N2O3.C13H20N2O2.C12H18N2O2.C11H17N3O.4C10H16N2O3.C10H16N2O.C9H11F3N2O.C9H15N3.C9H14N2O.C9H14N2.C8H12N2O.3C8H12N2.C7H10N2O.2C7H10N2/c1-10(2)13-6-12(7-15-16-13)18-8-11(17)9-19-14(3,4)5;1-9(2)12-14-10(3)5-11(15-12)17-8-13(4)6-16-7-13;1-9(2)11-13-5-4-10(14-11)16-8-12(3)6-15-7-12;1-9(2)10-7-12-8-11(13-10)14-3-5-15-6-4-14;3*1-7(2)9-3-11-4-10(12-9)15-6-8(14)5-13;1-7(2)10-11-4-3-9(12-10)15-6-8(14)5-13;1-7(2)9-5-6-10(12-11-9)13-8(3)4;1-6(2)8-13-4-3-7(14-8)15-5-9(10,11)12;1-7(2)9-5-8(12(3)4)6-10-11-9;1-4-12-9-6-5-8(7(2)3)10-11-9;1-6(2)9-8(4)11-7(3)5-10-9;1-6(2)7-4-5-8(11-3)10-9-7;1-6(2)8-5-9-7(3)4-10-8;1-6(2)8-7(3)4-5-9-10-8;1-6(2)8-5-4-7(3)9-10-8;1-5(2)6-3-9-7(10)4-8-6;1-6(2)7-5-8-3-4-9-7;1-6(2)7-4-3-5-8-9-7/h6-7,10-11,17H,8-9H2,1-5H3;5,9H,6-8H2,1-4H3;4-5,9H,6-8H2,1-3H3;7-9H,3-6H2,1-2H3;4*3-4,7-8,13-14H,5-6H2,1-2H3;5-8H,1-4H3;3-4,6H,5H2,1-2H3;5-7H,1-4H3;5-7H,4H2,1-3H3;5-6H,1-4H3;4-6H,1-3H3;3*4-6H,1-3H3;3-5H,1-2H3,(H,9,10);2*3-6H,1-2H3/t;;;;2*8-;;;;;;;;;;;;;;/m....10............../s1.
What are the key properties of 3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine?
3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine has a molecular weight of 3608.67 g/mol, XLogP of 31.50, 56 rotatable bonds, 10 hydrogen bond donors, and 66 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-2-propan-2-ylpyrazine;N,N-dimethyl-6-propan-2-ylpyridazin-4-amine;3-ethoxy-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;4-methyl-6-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;4-[(3-methyloxetan-3-yl)methoxy]-2-propan-2-ylpyrimidine;1-[(2-methylpropan-2-yl)oxy]-3-(6-propan-2-ylpyridazin-4-yl)oxypropan-2-ol;2-methyl-5-propan-2-ylpyrazine;3-methyl-6-propan-2-ylpyridazine;4-methyl-3-propan-2-ylpyridazine;3-propan-2-yl-6-propan-2-yloxypyridazine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazin-2-one;4-(6-propan-2-ylpyrazin-2-yl)morpholine;(2R)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;(2S)-3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-(6-propan-2-ylpyrazin-2-yl)oxypropane-1,2-diol;3-propan-2-ylpyridazine;3-(2-propan-2-ylpyrimidin-4-yl)oxypropane-1,2-diol;2-propan-2-yl-4-(2,2,2-trifluoroethoxy)pyrimidine is sourced from PubChem (CID 157227881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).