4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane

C153H253N27O6 — CID 157367408

IUPAC4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane
SMILESC.C.CC(C)(C)CCOc1ccccn1.CC(C)(C)CCOc1ccccn1.CC(C)(C)CCOc1nccc(C2CC2)n1.CC(C)(C)CCOc1ncccn1.CC(C)(C)CCn1cc(-c2cccnc2)cn1.CC(C)(C)CCn1cccc1.CC(C)(C)CCn1cccn1.CC(C)(C)CCn1cncn1.CC(C)(C)Cc1cc(-c2ccccn2)on1.Cc1cc(C)n(CCC(C)(C)C)n1.Cc1ccn(CCC(C)(C)C)n1.Cc1ccnn1CCC(C)(C)C.Cc1cnc(OCCC(C)(C)C)nc1.Cc1cnn(CCC(C)(C)C)c1
InChIInChI=1S/C14H19N3.C13H20N2O.C13H16N2O.C11H18N2O.C11H20N2.2C11H17NO.C10H16N2O.3C10H18N2.C10H17N.C9H16N2.C8H15N3.2CH4/c1-14(2,3)6-8-17-11-13(10-16-17)12-5-4-7-15-9-12;1-13(2,3)7-9-16-12-14-8-6-11(15-12)10-4-5-10;1-13(2,3)9-10-8-12(16-15-10)11-6-4-5-7-14-11;1-9-7-12-10(13-8-9)14-6-5-11(2,3)4;1-9-8-10(2)13(12-9)7-6-11(3,4)5;2*1-11(2,3)7-9-13-10-6-4-5-8-12-10;1-10(2,3)5-8-13-9-11-6-4-7-12-9;1-9-5-7-12(11-9)8-6-10(2,3)4;1-9-5-7-11-12(9)8-6-10(2,3)4;1-9-7-11-12(8-9)6-5-10(2,3)4;1-10(2,3)6-9-11-7-4-5-8-11;1-9(2,3)5-8-11-7-4-6-10-11;1-8(2,3)4-5-11-7-9-6-10-11;;/h4-5,7,9-11H,6,8H2,1-3H3;6,8,10H,4-5,7,9H2,1-3H3;4-8H,9H2,1-3H3;7-8H,5-6H2,1-4H3;8H,6-7H2,1-5H3;2*4-6,8H,7,9H2,1-3H3;4,6-7H,5,8H2,1-3H3;2*5,7H,6,8H2,1-4H3;7-8H,5-6H2,1-4H3;4-5,7-8H,6,9H2,1-3H3;4,6-7H,5,8H2,1-3H3;6-7H,4-5H2,1-3H3;2*1H4
InChIKeyBJIUBDOSVBKTKK-UHFFFAOYSA-N
MW2566.89 g/mol
LogP39.61
Rot. Bonds35

About 4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane

4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane (PubChem CID 157367408) has the molecular formula C153H253N27O6 and a molecular weight of 2566.89 g/mol. Its IUPAC name is 4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane.

Molecular Properties

Compound Name4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane
PubChem CID157367408
Molecular FormulaC153H253N27O6
Molecular Weight2566.89 g/mol
Exact Mass2565.03
IUPAC Name4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane
SMILESC.C.CC(C)(C)CCOc1ccccn1.CC(C)(C)CCOc1ccccn1.CC(C)(C)CCOc1nccc(C2CC2)n1.CC(C)(C)CCOc1ncccn1.CC(C)(C)CCn1cc(-c2cccnc2)cn1.CC(C)(C)CCn1cccc1.CC(C)(C)CCn1cccn1.CC(C)(C)CCn1cncn1.CC(C)(C)Cc1cc(-c2ccccn2)on1.Cc1cc(C)n(CCC(C)(C)C)n1.Cc1ccn(CCC(C)(C)C)n1.Cc1ccnn1CCC(C)(C)C.Cc1cnc(OCCC(C)(C)C)nc1.Cc1cnn(CCC(C)(C)C)c1
InChIInChI=1S/C14H19N3.C13H20N2O.C13H16N2O.C11H18N2O.C11H20N2.2C11H17NO.C10H16N2O.3C10H18N2.C10H17N.C9H16N2.C8H15N3.2CH4/c1-14(2,3)6-8-17-11-13(10-16-17)12-5-4-7-15-9-12;1-13(2,3)7-9-16-12-14-8-6-11(15-12)10-4-5-10;1-13(2,3)9-10-8-12(16-15-10)11-6-4-5-7-14-11;1-9-7-12-10(13-8-9)14-6-5-11(2,3)4;1-9-8-10(2)13(12-9)7-6-11(3,4)5;2*1-11(2,3)7-9-13-10-6-4-5-8-12-10;1-10(2,3)5-8-13-9-11-6-4-7-12-9;1-9-5-7-12(11-9)8-6-10(2,3)4;1-9-5-7-11-12(9)8-6-10(2,3)4;1-9-7-11-12(8-9)6-5-10(2,3)4;1-10(2,3)6-9-11-7-4-5-8-11;1-9(2,3)5-8-11-7-4-6-10-11;1-8(2,3)4-5-11-7-9-6-10-11;;/h4-5,7,9-11H,6,8H2,1-3H3;6,8,10H,4-5,7,9H2,1-3H3;4-8H,9H2,1-3H3;7-8H,5-6H2,1-4H3;8H,6-7H2,1-5H3;2*4-6,8H,7,9H2,1-3H3;4,6-7H,5,8H2,1-3H3;2*5,7H,6,8H2,1-4H3;7-8H,5-6H2,1-4H3;4-5,7-8H,6,9H2,1-3H3;4,6-7H,5,8H2,1-3H3;6-7H,4-5H2,1-3H3;2*1H4
InChIKeyBJIUBDOSVBKTKK-UHFFFAOYSA-N
XLogP39.61
TPSA343.64 Ų
H-Bond Donors
H-Bond Acceptors33
Rotatable Bonds35
Heavy Atoms186
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002566.89
LogP ≤ 539.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1033

Analyze 4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane with MolForge

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Related Compounds

Tert-butylbenzene;tert-butylcyclobutane;5-tert-butyl-3-methyl-1,2,4-oxadiazole;3-tert-butyl-5-methyl-1,2-oxazole;4-tert-butyl-1-methylpyrazole;2-tert-butyl-5-methylpyrimidine;4-tert-butyl-1-methyltriazole;2-tert-butyl-1,3-oxazole;3-tert-butyloxolane;3-tert-butylpyridazine;2-tert-butylpyridine;3-tert-butylpyridine;5-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)furan;bis(propan-2-ylcyclopropane);2-propan-2-yloxane;2-propan-2-yloxetane
CID 160685128
2,2-Dimethylpropylbenzene;2,2-dimethylpropylcyclobutane;bis(2,2-dimethylpropylcyclopropane);5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-methyl-1,2-oxazole;4-(2,2-dimethylpropyl)-1-methylpyrazole;2-(2,2-dimethylpropyl)-5-methylpyrimidine;4-(2,2-dimethylpropyl)-1-methyltriazole;2-(2,2-dimethylpropyl)oxane;2-(2,2-dimethylpropyl)-1,3-oxazole;2-(2,2-dimethylpropyl)oxetane;3-(2,2-dimethylpropyl)oxolane;3-(2,2-dimethylpropyl)pyridazine;2-(2,2-dimethylpropyl)pyridine;3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)pyrimidine;2-(2,2-dimethylpropyl)-5-(trifluoromethyl)furan
CID 161024068
3-(1-Benzyl-2-tert-butylpyrrolo[2,3-b]pyridin-4-yl)oxypropan-1-ol;3-(1-benzyl-2-tert-butylpyrrolo[2,3-b]pyridin-5-yl)oxypropan-1-ol;3-(1-benzyl-2-tert-butylpyrrolo[2,3-b]pyridin-6-yl)oxypropan-1-ol;2-tert-butyl-1-(cyclohexylmethyl)pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[(1-methylpyrazol-4-yl)methyl]pyrrolo[2,3-b]pyridine;2-tert-butyl-1-[[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]methyl]pyrrolo[2,3-b]pyridine;4-[(2-tert-butylpyrrolo[2,3-b]pyridin-1-yl)methyl]-3,5-dimethyl-1,2-oxazole
CID 161767402
3-Benzyl-5-(2,2-dimethylpropyl)-1,2-oxazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;bis(2-(3,3-dimethylbutyl)pyridine);2-(3,3-dimethylbutyl)pyrimidine;2-[[1-(2,2-dimethylpropyl)cyclopropyl]methoxy]pyrimidine;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole;5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-methyl-1,2-oxazole;5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole;2-(2,2-dimethylpropyl)-5-methylpyrimidine;5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyrimidine;2-(2,2,4,4-tetramethylpentoxy)pyrimidine
CID 157051058
2-(Azetidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyridine;4-(azetidin-1-ylmethyl)-2-propan-2-ylpyridine;5-(azetidin-1-ylmethyl)-2-propan-2-ylpyridine;2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine;2-(azetidin-1-yl)-4-propan-2-ylpyridine;2-(azetidin-1-yl)-6-propan-2-ylpyridine;methane;5-methyl-3-propan-2-yl-1,2-oxazole;2-(piperidin-1-ylmethyl)-6-propan-2-ylpyrazine;2-(piperidin-1-ylmethyl)-4-propan-2-ylpyrimidine;2-propan-2-ylfuran;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;2-propan-2-ylpyridine;2-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;bis(2-propan-2-yl-5-(pyrrolidin-1-ylmethyl)pyridine);2-propan-2-yl-6-(pyrrolidin-1-ylmethyl)pyridine
CID 157172849
5-tert-butyl-N-methyl-1,2-oxazol-3-amine;bis(3-cyclopropyl-N,1-dimethylpyrazol-5-amine);[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide
CID 157441878
2-(5,6-Dimethyl-2-pyridinyl)-1-[6-(2-methylpyrimidin-5-yl)oxy-[1,2,4]triazolo[4,3-a]pyridin-8-yl]ethanone;2-(6-ethyl-2-pyridinyl)-1-[6-(2-methylpyrimidin-5-yl)oxy-[1,2,4]triazolo[4,3-a]pyridin-8-yl]ethanone;2-(5-methoxy-2-pyridinyl)-1-[6-(2-methylpyrimidin-5-yl)oxy-[1,2,4]triazolo[4,3-a]pyridin-8-yl]ethanone;2-(6-methoxy-2-pyridinyl)-1-[6-(2-methylpyrimidin-5-yl)oxy-[1,2,4]triazolo[4,3-a]pyridin-8-yl]ethanone;bis(2-(5-methyl-2-pyridinyl)-1-[6-(2-methylpyrimidin-5-yl)oxy-[1,2,4]triazolo[4,3-a]pyridin-8-yl]ethanone);2-(6-methyl-2-pyridinyl)-1-[6-(2-methylpyrimidin-5-yl)oxy-[1,2,4]triazolo[4,3-a]pyridin-8-yl]ethanone
CID 157688808
3-Benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-chloro-2-(2,2-dimethylpropyl)pyrimidine;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutyl)-6-methylpyridine;2-(3,3-dimethylbutyl)pyridine;2-(3,3-dimethylbutyl)pyrimidine;4-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole;5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-methyl-1,2-oxazole;5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole;5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;bis(2-(2,2-dimethylpropyl)pyrimidine);methane
CID 157715177
3-Benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;bis(2-(3,3-dimethylbutyl)pyridine);2-(3,3-dimethylbutyl)pyrimidine;2-[[1-(2,2-dimethylpropyl)cyclopropyl]methoxy]pyrimidine;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;3-(2,2-dimethylpropyl)-5-methyl-1,2,4-oxadiazole;5-(2,2-dimethylpropyl)-3-methyl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-methyl-1,2-oxazole;5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole;2-(2,2-dimethylpropyl)-5-methylpyrimidine;5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyrimidine;2-(2,2,4,4-tetramethylpentoxy)pyrimidine
CID 157756450
3-Benzyl-5-(2,2-dimethylpropyl)-1,2,4-oxadiazole;5-cyclopropyl-3-(2,2-dimethylpropyl)-1,2,4-oxadiazole;2-(3,3-dimethylbutyl)-6-methylpyridine;bis(2-(3,3-dimethylbutyl)pyridine);2-(3,3-dimethylbutyl)pyrimidine;2-(2,2-dimethylpropyl)-4,5-dimethyl-1,3-oxazole;2-(2,2-dimethylpropyl)-4-methylfuran;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-5-methyl-1,2-oxazole;5-(2,2-dimethylpropyl)-2-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole;5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazole;2-(2,2-dimethylpropyl)pyridine;bis(2-(2,2-dimethylpropyl)pyrimidine)
CID 157879531
2-(6-Ethyl-2-pyridinyl)-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[4,3-a]pyridin-8-yl)ethanone;2-(6-methoxy-2-pyridinyl)-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[4,3-a]pyridin-8-yl)ethanone;2-(5-methyl-2-pyridinyl)-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[4,3-a]pyridin-8-yl)ethanone;bis(2-(6-methyl-2-pyridinyl)-1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[4,3-a]pyridin-8-yl)ethanone);1-(6-pyrimidin-5-yloxy-[1,2,4]triazolo[4,3-a]pyridin-8-yl)-2-(3,4,6-trideuterio-5-methyl-2-pyridinyl)ethanone
CID 158744498
4-Cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;4-(3,3-dimethylbutyl)pyrimidine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;1-(4,4-dimethylpentan-2-yl)pyrazole;2-(2,2-dimethylpropyl)-4-methoxypyrimidine;2-(2,2-dimethylpropyl)-5-methylpyrimidine;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane
CID 158780566

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane?
The IUPAC name of 4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane (CID 157367408) is 4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane.
What is the SMILES notation for 4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane?
The canonical SMILES for 4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane is C.C.CC(C)(C)CCOc1ccccn1.CC(C)(C)CCOc1ccccn1.CC(C)(C)CCOc1nccc(C2CC2)n1.CC(C)(C)CCOc1ncccn1.CC(C)(C)CCn1cc(-c2cccnc2)cn1.CC(C)(C)CCn1cccc1.CC(C)(C)CCn1cccn1.CC(C)(C)CCn1cncn1.CC(C)(C)Cc1cc(-c2ccccn2)on1.Cc1cc(C)n(CCC(C)(C)C)n1.Cc1ccn(CCC(C)(C)C)n1.Cc1ccnn1CCC(C)(C)C.Cc1cnc(OCCC(C)(C)C)nc1.Cc1cnn(CCC(C)(C)C)c1.
What is the InChIKey of 4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane?
The InChIKey is BJIUBDOSVBKTKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3.C13H20N2O.C13H16N2O.C11H18N2O.C11H20N2.2C11H17NO.C10H16N2O.3C10H18N2.C10H17N.C9H16N2.C8H15N3.2CH4/c1-14(2,3)6-8-17-11-13(10-16-17)12-5-4-7-15-9-12;1-13(2,3)7-9-16-12-14-8-6-11(15-12)10-4-5-10;1-13(2,3)9-10-8-12(16-15-10)11-6-4-5-7-14-11;1-9-7-12-10(13-8-9)14-6-5-11(2,3)4;1-9-8-10(2)13(12-9)7-6-11(3,4)5;2*1-11(2,3)7-9-13-10-6-4-5-8-12-10;1-10(2,3)5-8-13-9-11-6-4-7-12-9;1-9-5-7-12(11-9)8-6-10(2,3)4;1-9-5-7-11-12(9)8-6-10(2,3)4;1-9-7-11-12(8-9)6-5-10(2,3)4;1-10(2,3)6-9-11-7-4-5-8-11;1-9(2,3)5-8-11-7-4-6-10-11;1-8(2,3)4-5-11-7-9-6-10-11;;/h4-5,7,9-11H,6,8H2,1-3H3;6,8,10H,4-5,7,9H2,1-3H3;4-8H,9H2,1-3H3;7-8H,5-6H2,1-4H3;8H,6-7H2,1-5H3;2*4-6,8H,7,9H2,1-3H3;4,6-7H,5,8H2,1-3H3;2*5,7H,6,8H2,1-4H3;7-8H,5-6H2,1-4H3;4-5,7-8H,6,9H2,1-3H3;4,6-7H,5,8H2,1-3H3;6-7H,4-5H2,1-3H3;2*1H4.
What are the key properties of 4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane?
4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane has a molecular weight of 2566.89 g/mol, XLogP of 39.61, 35 rotatable bonds, 0 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-2-(3,3-dimethylbutoxy)pyrimidine;2-(3,3-dimethylbutoxy)-5-methylpyrimidine;bis(2-(3,3-dimethylbutoxy)pyridine);2-(3,3-dimethylbutoxy)pyrimidine;1-(3,3-dimethylbutyl)-3,5-dimethylpyrazole;1-(3,3-dimethylbutyl)-3-methylpyrazole;1-(3,3-dimethylbutyl)-4-methylpyrazole;1-(3,3-dimethylbutyl)-5-methylpyrazole;1-(3,3-dimethylbutyl)pyrazole;3-[1-(3,3-dimethylbutyl)pyrazol-4-yl]pyridine;1-(3,3-dimethylbutyl)pyrrole;1-(3,3-dimethylbutyl)-1,2,4-triazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole;methane is sourced from PubChem (CID 157367408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).