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

C170H257F2N25O17 — CID 158002540

IUPAC4-(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
SMILESCC(C)Oc1ccc(C(C)C)nn1.CC(C)c1cc(N(C)C)ccn1.CC(C)c1cc(OCC(O)COC(C)(C)C)ccn1.CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccccn1.CC(C)c1cncc(OC[C@H](O)CO)n1.CC(C)c1cnccn1.CC(C)c1nccc(OCC(C)(F)F)n1.CC(C)c1nccc(OCC2(C)COC2)n1.CCC(O)COc1cncc(C(C)C)n1.CCOc1ccc(C(C)C)nc1.COc1ccc(C(C)C)nc1.Cc1cc(OCC2(C)COC2)nc(C(C)C)n1.Cc1ccc(C(C)C)c(C)n1.Cc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)nc1.Cc1cccnc1C(C)C
InChIInChI=1S/C15H25NO3.C13H20N2O2.C12H18N2O2.C11H18N2O2.C10H14F2N2O.C10H16N2O3.C10H16N2O.C10H16N2.C10H15NO.C10H15N.C9H13NO.3C9H13N.C8H11NO.C8H11N.C7H10N2/c1-11(2)14-8-13(6-7-16-14)18-9-12(17)10-19-15(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;1-4-9(14)7-15-11-6-12-5-10(13-11)8(2)3;1-7(2)9-13-5-4-8(14-9)15-6-10(3,11)12;1-7(2)9-3-11-4-10(12-9)15-6-8(14)5-13;1-7(2)9-5-6-10(12-11-9)13-8(3)4;1-8(2)10-7-9(12(3)4)5-6-11-10;1-4-12-9-5-6-10(8(2)3)11-7-9;1-7(2)10-6-5-8(3)11-9(10)4;1-7(2)9-5-4-8(11-3)6-10-9;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-8(3)5-4-6-10-9;1-6(2)7-3-4-8(10)9-5-7;1-7(2)8-5-3-4-6-9-8;1-6(2)7-5-8-3-4-9-7/h6-8,11-12,17H,9-10H2,1-5H3;5,9H,6-8H2,1-4H3;4-5,9H,6-8H2,1-3H3;5-6,8-9,14H,4,7H2,1-3H3;4-5,7H,6H2,1-3H3;3-4,7-8,13-14H,5-6H2,1-2H3;5-8H,1-4H3;5-8H,1-4H3;5-8H,4H2,1-3H3;5-7H,1-4H3;4-7H,1-3H3;3*4-7H,1-3H3;3-6H,1-2H3,(H,9,10);3-7H,1-2H3;3-6H,1-2H3/t;;;;;8-;;;;;;;;;;;/m.....1.........../s1
InChIKeyFDXDLZGXODHLQU-PJMZCIBWSA-N
MW2961.08 g/mol
LogP36.96
Rot. Bonds45

About 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

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 (PubChem CID 158002540) has the molecular formula C170H257F2N25O17 and a molecular weight of 2961.08 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name4-(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
PubChem CID158002540
Molecular FormulaC170H257F2N25O17
Molecular Weight2961.08 g/mol
Exact Mass2959.00
IUPAC Name4-(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
SMILESCC(C)Oc1ccc(C(C)C)nn1.CC(C)c1cc(N(C)C)ccn1.CC(C)c1cc(OCC(O)COC(C)(C)C)ccn1.CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccccn1.CC(C)c1cncc(OC[C@H](O)CO)n1.CC(C)c1cnccn1.CC(C)c1nccc(OCC(C)(F)F)n1.CC(C)c1nccc(OCC2(C)COC2)n1.CCC(O)COc1cncc(C(C)C)n1.CCOc1ccc(C(C)C)nc1.COc1ccc(C(C)C)nc1.Cc1cc(OCC2(C)COC2)nc(C(C)C)n1.Cc1ccc(C(C)C)c(C)n1.Cc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)nc1.Cc1cccnc1C(C)C
InChIInChI=1S/C15H25NO3.C13H20N2O2.C12H18N2O2.C11H18N2O2.C10H14F2N2O.C10H16N2O3.C10H16N2O.C10H16N2.C10H15NO.C10H15N.C9H13NO.3C9H13N.C8H11NO.C8H11N.C7H10N2/c1-11(2)14-8-13(6-7-16-14)18-9-12(17)10-19-15(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;1-4-9(14)7-15-11-6-12-5-10(13-11)8(2)3;1-7(2)9-13-5-4-8(14-9)15-6-10(3,11)12;1-7(2)9-3-11-4-10(12-9)15-6-8(14)5-13;1-7(2)9-5-6-10(12-11-9)13-8(3)4;1-8(2)10-7-9(12(3)4)5-6-11-10;1-4-12-9-5-6-10(8(2)3)11-7-9;1-7(2)10-6-5-8(3)11-9(10)4;1-7(2)9-5-4-8(11-3)6-10-9;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-8(3)5-4-6-10-9;1-6(2)7-3-4-8(10)9-5-7;1-7(2)8-5-3-4-6-9-8;1-6(2)7-5-8-3-4-9-7/h6-8,11-12,17H,9-10H2,1-5H3;5,9H,6-8H2,1-4H3;4-5,9H,6-8H2,1-3H3;5-6,8-9,14H,4,7H2,1-3H3;4-5,7H,6H2,1-3H3;3-4,7-8,13-14H,5-6H2,1-2H3;5-8H,1-4H3;5-8H,1-4H3;5-8H,4H2,1-3H3;5-7H,1-4H3;4-7H,1-3H3;3*4-7H,1-3H3;3-6H,1-2H3,(H,9,10);3-7H,1-2H3;3-6H,1-2H3/t;;;;;8-;;;;;;;;;;;/m.....1.........../s1
InChIKeyFDXDLZGXODHLQU-PJMZCIBWSA-N
XLogP36.96
TPSA524.25 Ų
H-Bond Donors5
H-Bond Acceptors41
Rotatable Bonds45
Heavy Atoms214
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002961.08
LogP ≤ 536.96
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1041

Analyze 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 with MolForge

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Launch Full Analysis

Related Compounds

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
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
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
1-cyclopropyl-4-(methylamino)pyridin-2-one;6-(cyclopropylmethyl)-N-methylpyridazin-3-amine;6-(cyclopropylmethyl)-N-methylpyridin-3-amine;2-(cyclopropylmethyl)-N-methylpyrimidin-5-amine;5-cyclopropyl-N-methylpyrazin-2-amine;6-cyclopropyl-N-methylpyridazin-3-amine;5-cyclopropyl-N-methylpyridin-2-amine;6-cyclopropyl-N-methylpyridin-3-amine;2-cyclopropyl-N-methylpyrimidin-5-amine;5-cyclopropyl-N-methylpyrimidin-2-amine;5-cyclopropyloxy-N-methylpyrazin-2-amine;6-cyclopropyloxy-N-methylpyridin-3-amine;1-[6-(1,1-difluoroethyl)-3-pyridinyl]-N-methylmethanamine;6-(difluoromethoxy)-N-methylpyridin-3-amine;6-(1-fluoroethyl)-N-methylpyridin-3-amine;1-[5-(methylamino)-2-pyridinyl]cyclopropane-1-carbonitrile;N-methyl-6-propylpyridin-3-amine;2-N,2-N,5-N-trimethylpyridine-2,5-diamine
CID 159021317
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
2-(2,2-difluoropropoxy)-4-propan-2-ylpyridine;2,3-dimethyl-4-propan-2-ylpyridine;2,6-dimethyl-4-propan-2-ylpyridine;2-ethoxy-4-propan-2-ylpyridine;3-fluoro-2-methyl-4-propan-2-ylpyridine;2-methyl-4-propan-2-ylpyridine;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;(2R)-1-[(6-methyl-4-propan-2-yl-2-pyridinyl)oxy]butan-2-ol;2-(piperidin-1-ylmethyl)-4-propan-2-ylpyrimidine;4-propan-2-yl-1H-pyridin-2-one;4-[(4-propan-2-yl-2-pyridinyl)methyl]morpholine;4-propan-2-ylpyrimidine;3-(4-propan-2-ylpyrimidin-2-yl)oxypropane-1,2-diol;4-propan-2-yl-2-(pyrrolidin-1-ylmethyl)pyridine
CID 159650839
(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

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC(C)Oc1ccc(C(C)C)nn1.CC(C)c1cc(N(C)C)ccn1.CC(C)c1cc(OCC(O)COC(C)(C)C)ccn1.CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccccn1.CC(C)c1cncc(OC[C@H](O)CO)n1.CC(C)c1cnccn1.CC(C)c1nccc(OCC(C)(F)F)n1.CC(C)c1nccc(OCC2(C)COC2)n1.CCC(O)COc1cncc(C(C)C)n1.CCOc1ccc(C(C)C)nc1.COc1ccc(C(C)C)nc1.Cc1cc(OCC2(C)COC2)nc(C(C)C)n1.Cc1ccc(C(C)C)c(C)n1.Cc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)nc1.Cc1cccnc1C(C)C.
What is the InChIKey of 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?
The InChIKey is FDXDLZGXODHLQU-PJMZCIBWSA-N. The full InChI is InChI=1S/C15H25NO3.C13H20N2O2.C12H18N2O2.C11H18N2O2.C10H14F2N2O.C10H16N2O3.C10H16N2O.C10H16N2.C10H15NO.C10H15N.C9H13NO.3C9H13N.C8H11NO.C8H11N.C7H10N2/c1-11(2)14-8-13(6-7-16-14)18-9-12(17)10-19-15(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;1-4-9(14)7-15-11-6-12-5-10(13-11)8(2)3;1-7(2)9-13-5-4-8(14-9)15-6-10(3,11)12;1-7(2)9-3-11-4-10(12-9)15-6-8(14)5-13;1-7(2)9-5-6-10(12-11-9)13-8(3)4;1-8(2)10-7-9(12(3)4)5-6-11-10;1-4-12-9-5-6-10(8(2)3)11-7-9;1-7(2)10-6-5-8(3)11-9(10)4;1-7(2)9-5-4-8(11-3)6-10-9;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-8(3)5-4-6-10-9;1-6(2)7-3-4-8(10)9-5-7;1-7(2)8-5-3-4-6-9-8;1-6(2)7-5-8-3-4-9-7/h6-8,11-12,17H,9-10H2,1-5H3;5,9H,6-8H2,1-4H3;4-5,9H,6-8H2,1-3H3;5-6,8-9,14H,4,7H2,1-3H3;4-5,7H,6H2,1-3H3;3-4,7-8,13-14H,5-6H2,1-2H3;5-8H,1-4H3;5-8H,1-4H3;5-8H,4H2,1-3H3;5-7H,1-4H3;4-7H,1-3H3;3*4-7H,1-3H3;3-6H,1-2H3,(H,9,10);3-7H,1-2H3;3-6H,1-2H3/t;;;;;8-;;;;;;;;;;;/m.....1.........../s1.
What are the key properties of 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?
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 has a molecular weight of 2961.08 g/mol, XLogP of 36.96, 45 rotatable bonds, 5 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 158002540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).