1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one

C208H321ClN42O4S7 — CID 159849775

IUPAC1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one
SMILESCC(C)(C)c1cncc(C#N)n1.CC(C)(C)c1cnccn1.CC(C)(C)c1cscn1.CC(C)N1CCC(C(C)(C)C)CC1.CC(C)c1ccccc1C(C)(C)C.CC(C)c1cncc(-n2ccccc2=O)n1.CC(C)c1cncc(-n2ccnc2)n1.CC(C)c1cncc(Cl)n1.CC(C)c1cncc(N(C)C)n1.CC(C)c1cncc(N2CCCC2)n1.CC(C)c1cncc(N2CCOCC2)n1.CC(C)c1csc(-n2ccccc2=O)n1.CC(C)c1csc(-n2ccnc2)n1.CC(C)c1nc(C(C)(C)C)cs1.CCN(C)c1nc(C(C)C)cs1.CCN(CC)c1cncc(C(C)C)n1.CCN(CC)c1nc(C(C)C)cs1.CCc1ccccc1C(C)(C)C.CN1CCC(C(C)(C)C)CC1.COc1cncc(C(C)(C)C)n1.Cc1nc(C(C)(C)C)cs1
InChIInChI=1S/C13H20.C12H13N3O.C12H25N.C12H18.C11H17N3O.C11H17N3.C11H19N3.C11H12N2OS.C10H12N4.C10H18N2S.C10H17NS.C10H21N.C9H11N3S.C9H11N3.C9H15N3.C9H14N2O.C9H16N2S.C8H12N2.C8H13NS.C7H9ClN2.C7H11NS/c1-10(2)11-8-6-7-9-12(11)13(3,4)5;1-9(2)10-7-13-8-11(14-10)15-6-4-3-5-12(15)16;1-10(2)13-8-6-11(7-9-13)12(3,4)5;1-5-10-8-6-7-9-11(10)12(2,3)4;1-9(2)10-7-12-8-11(13-10)14-3-5-15-6-4-14;1-9(2)10-7-12-8-11(13-10)14-5-3-4-6-14;1-5-14(6-2)11-8-12-7-10(13-11)9(3)4;1-8(2)9-7-15-11(12-9)13-6-4-3-5-10(13)14;1-8(2)9-5-12-6-10(13-9)14-4-3-11-7-14;1-5-12(6-2)10-11-9(7-13-10)8(3)4;1-7(2)9-11-8(6-12-9)10(3,4)5;1-10(2,3)9-5-7-11(4)8-6-9;1-7(2)8-5-13-9(11-8)12-4-3-10-6-12;1-9(2,3)8-6-11-5-7(4-10)12-8;1-7(2)8-5-10-6-9(11-8)12(3)4;1-9(2,3)7-5-10-6-8(11-7)12-4;1-5-11(4)9-10-8(6-12-9)7(2)3;1-8(2,3)7-6-9-4-5-10-7;1-6-9-7(5-10-6)8(2,3)4;1-5(2)6-3-9-4-7(8)10-6;1-7(2,3)6-4-9-5-8-6/h6-10H,1-5H3;3-9H,1-2H3;10-11H,6-9H2,1-5H3;6-9H,5H2,1-4H3;7-9H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;7-9H,5-6H2,1-4H3;3-8H,1-2H3;3-8H,1-2H3;7-8H,5-6H2,1-4H3;6-7H,1-5H3;9H,5-8H2,1-4H3;3-7H,1-2H3;5-6H,1-3H3;5-7H,1-4H3;5-6H,1-4H3;6-7H,5H2,1-4H3;4-6H,1-3H3;5H,1-4H3;3-5H,1-2H3;4-5H,1-3H3
InChIKeyNPTZAAHEEDKWCM-UHFFFAOYSA-N
MW3734.07 g/mol
LogP51.38
Rot. Bonds31

About 1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one

1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one (PubChem CID 159849775) has the molecular formula C208H321ClN42O4S7 and a molecular weight of 3734.07 g/mol. Its IUPAC name is 1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one.

Molecular Properties

Compound Name1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one
PubChem CID159849775
Molecular FormulaC208H321ClN42O4S7
Molecular Weight3734.07 g/mol
Exact Mass3730.39
IUPAC Name1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one
SMILESCC(C)(C)c1cncc(C#N)n1.CC(C)(C)c1cnccn1.CC(C)(C)c1cscn1.CC(C)N1CCC(C(C)(C)C)CC1.CC(C)c1ccccc1C(C)(C)C.CC(C)c1cncc(-n2ccccc2=O)n1.CC(C)c1cncc(-n2ccnc2)n1.CC(C)c1cncc(Cl)n1.CC(C)c1cncc(N(C)C)n1.CC(C)c1cncc(N2CCCC2)n1.CC(C)c1cncc(N2CCOCC2)n1.CC(C)c1csc(-n2ccccc2=O)n1.CC(C)c1csc(-n2ccnc2)n1.CC(C)c1nc(C(C)(C)C)cs1.CCN(C)c1nc(C(C)C)cs1.CCN(CC)c1cncc(C(C)C)n1.CCN(CC)c1nc(C(C)C)cs1.CCc1ccccc1C(C)(C)C.CN1CCC(C(C)(C)C)CC1.COc1cncc(C(C)(C)C)n1.Cc1nc(C(C)(C)C)cs1
InChIInChI=1S/C13H20.C12H13N3O.C12H25N.C12H18.C11H17N3O.C11H17N3.C11H19N3.C11H12N2OS.C10H12N4.C10H18N2S.C10H17NS.C10H21N.C9H11N3S.C9H11N3.C9H15N3.C9H14N2O.C9H16N2S.C8H12N2.C8H13NS.C7H9ClN2.C7H11NS/c1-10(2)11-8-6-7-9-12(11)13(3,4)5;1-9(2)10-7-13-8-11(14-10)15-6-4-3-5-12(15)16;1-10(2)13-8-6-11(7-9-13)12(3,4)5;1-5-10-8-6-7-9-11(10)12(2,3)4;1-9(2)10-7-12-8-11(13-10)14-3-5-15-6-4-14;1-9(2)10-7-12-8-11(13-10)14-5-3-4-6-14;1-5-14(6-2)11-8-12-7-10(13-11)9(3)4;1-8(2)9-7-15-11(12-9)13-6-4-3-5-10(13)14;1-8(2)9-5-12-6-10(13-9)14-4-3-11-7-14;1-5-12(6-2)10-11-9(7-13-10)8(3)4;1-7(2)9-11-8(6-12-9)10(3,4)5;1-10(2,3)9-5-7-11(4)8-6-9;1-7(2)8-5-13-9(11-8)12-4-3-10-6-12;1-9(2,3)8-6-11-5-7(4-10)12-8;1-7(2)8-5-10-6-9(11-8)12(3)4;1-9(2,3)7-5-10-6-8(11-7)12-4;1-5-11(4)9-10-8(6-12-9)7(2)3;1-8(2,3)7-6-9-4-5-10-7;1-6-9-7(5-10-6)8(2,3)4;1-5(2)6-3-9-4-7(8)10-6;1-7(2,3)6-4-9-5-8-6/h6-10H,1-5H3;3-9H,1-2H3;10-11H,6-9H2,1-5H3;6-9H,5H2,1-4H3;7-9H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;7-9H,5-6H2,1-4H3;3-8H,1-2H3;3-8H,1-2H3;7-8H,5-6H2,1-4H3;6-7H,1-5H3;9H,5-8H2,1-4H3;3-7H,1-2H3;5-6H,1-3H3;5-7H,1-4H3;5-6H,1-4H3;6-7H,5H2,1-4H3;4-6H,1-3H3;5H,1-4H3;3-5H,1-2H3;4-5H,1-3H3
InChIKeyNPTZAAHEEDKWCM-UHFFFAOYSA-N
XLogP51.38
TPSA495.84 Ų
H-Bond Donors
H-Bond Acceptors53
Rotatable Bonds31
Heavy Atoms262
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003734.07
LogP ≤ 551.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1053

Analyze 1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one with MolForge

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Launch Full Analysis

Related Compounds

1-tert-butyl-2-ethylbenzene;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;2-methoxy-6-propan-2-ylpyrazine;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(5-propan-2-ylpyrazin-2-yl)pyridin-2-one;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one
CID 157598522
1-tert-butyl-2-ethylbenzene;4-tert-butyl-1-methylpiperidine;4-tert-butyl-1-propan-2-ylpiperidine;2-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;2,4-di(propan-2-yl)-1,3-thiazole;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;2-methoxy-6-propan-2-ylpyrazine;2-methyl-4-propan-2-yl-1,3-thiazole;6-propan-2-ylpyrazine-2-carbonitrile;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(5-propan-2-ylpyrazin-2-yl)pyridin-2-one;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;4-propan-2-yl-1,3-thiazole;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one
CID 158379114
1-tert-butyl-2-ethylbenzene;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;1-tert-butyl-2-methylbenzene;4-tert-butyl-1-methylpiperidine;2-tert-butylphenol;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;2-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;1-(3,3-dimethylbutyl)pyrrolidine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;2,4-di(propan-2-yl)-1,3-thiazole;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;4-propan-2-yl-1,3-thiazole;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one
CID 158617112
1-tert-butyl-2-ethylbenzene;4-tert-butyl-1-methylpiperidine;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;2,4-di(propan-2-yl)-1,3-thiazole;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;2-methoxy-6-propan-2-ylpyrazine;2-methyl-4-propan-2-yl-1,3-thiazole;2-propan-2-ylpyrazine;6-propan-2-ylpyrazine-2-carbonitrile;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(5-propan-2-ylpyrazin-2-yl)pyridin-2-one;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;4-propan-2-yl-1,3-thiazole;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one
CID 158871547
1-tert-butyl-2-ethylbenzene;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;4-tert-butyl-1-methylpiperidine;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;2-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;2,4-di(propan-2-yl)-1,3-thiazole;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;4-propan-2-yl-1,3-thiazole;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one
CID 159017225
6-tert-butyl-N,N-diethylpyrazin-2-amine;4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine;6-tert-butyl-N,N-dimethylpyrazin-2-amine;1-tert-butyl-2-ethylbenzene;4-tert-butyl-1-methylpiperidine;2-tert-butyl-6-methylpyrazine;4-tert-butyl-2-methyl-1,3-thiazole;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;4-(6-tert-butylpyrazin-2-yl)morpholine;1-(6-tert-butylpyrazin-2-yl)pyridin-2-one;2-tert-butyl-6-pyrrolidin-1-ylpyrazine;2-tert-butyl-6-pyrrol-1-ylpyrazine;4-tert-butyl-2-pyrrol-1-yl-1,3-thiazole;4-tert-butyl-1,3-thiazole;1-(4-tert-butyl-1,3-thiazol-2-yl)pyridin-2-one;methane
CID 159480120
4-tert-butyl-1-propan-2-ylpiperidine;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;2,4-di(propan-2-yl)-1,3-thiazole;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;2-methoxy-6-propan-2-ylpyrazine;2-methyl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(5-propan-2-ylpyrazin-2-yl)pyridin-2-one;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;4-propan-2-yl-1,3-thiazole;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one
CID 159483686
2-tert-butyl-3-ethylpyridine;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;2-methoxy-6-propan-2-ylpyrazine;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(5-propan-2-ylpyrazin-2-yl)pyridin-2-one;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one
CID 159495209
2-tert-butyl-6-chloropyrazine;6-tert-butyl-N,N-diethylpyrazin-2-amine;6-tert-butyl-N,N-dimethylpyrazin-2-amine;1-tert-butyl-2-ethylbenzene;1-tert-butyl-2-fluorobenzene;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;2-tert-butyl-6-piperidin-1-ylpyrazine;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;1-(6-tert-butylpyrazin-2-yl)pyridin-2-one;2-tert-butyl-6-pyrrolidin-1-ylpyrazine;2-tert-butyl-6-pyrrol-1-ylpyrazine;4-tert-butyl-2-pyrrol-1-yl-1,3-thiazole;4-tert-butyl-1,3-thiazole
CID 159670075
1-tert-butyl-2-ethylbenzene;4-tert-butyl-1-methylpiperidine;4-tert-butyl-1-propan-2-ylpiperidine;2-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;2,4-di(propan-2-yl)-1,3-thiazole;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-methyl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;4-propan-2-yl-1,3-thiazole
CID 159995346
1-tert-butyl-2-ethylbenzene;1-tert-butyl-2-fluorobenzene;4-tert-butyl-1-methylpiperidine;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;2-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;2,4-di(propan-2-yl)-1,3-thiazole;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;4-propan-2-yl-1,3-thiazole;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one
CID 160125447
6-tert-butylpyrazine-2-carbonitrile;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;2-methoxy-6-propan-2-ylpyrazine;2-propan-2-ylpyrazine;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;4-propan-2-yl-1,3-thiazole;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one
CID 161211703

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one?
The IUPAC name of 1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one (CID 159849775) is 1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one.
What is the SMILES notation for 1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one?
The canonical SMILES for 1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one is CC(C)(C)c1cncc(C#N)n1.CC(C)(C)c1cnccn1.CC(C)(C)c1cscn1.CC(C)N1CCC(C(C)(C)C)CC1.CC(C)c1ccccc1C(C)(C)C.CC(C)c1cncc(-n2ccccc2=O)n1.CC(C)c1cncc(-n2ccnc2)n1.CC(C)c1cncc(Cl)n1.CC(C)c1cncc(N(C)C)n1.CC(C)c1cncc(N2CCCC2)n1.CC(C)c1cncc(N2CCOCC2)n1.CC(C)c1csc(-n2ccccc2=O)n1.CC(C)c1csc(-n2ccnc2)n1.CC(C)c1nc(C(C)(C)C)cs1.CCN(C)c1nc(C(C)C)cs1.CCN(CC)c1cncc(C(C)C)n1.CCN(CC)c1nc(C(C)C)cs1.CCc1ccccc1C(C)(C)C.CN1CCC(C(C)(C)C)CC1.COc1cncc(C(C)(C)C)n1.Cc1nc(C(C)(C)C)cs1.
What is the InChIKey of 1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one?
The InChIKey is NPTZAAHEEDKWCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20.C12H13N3O.C12H25N.C12H18.C11H17N3O.C11H17N3.C11H19N3.C11H12N2OS.C10H12N4.C10H18N2S.C10H17NS.C10H21N.C9H11N3S.C9H11N3.C9H15N3.C9H14N2O.C9H16N2S.C8H12N2.C8H13NS.C7H9ClN2.C7H11NS/c1-10(2)11-8-6-7-9-12(11)13(3,4)5;1-9(2)10-7-13-8-11(14-10)15-6-4-3-5-12(15)16;1-10(2)13-8-6-11(7-9-13)12(3,4)5;1-5-10-8-6-7-9-11(10)12(2,3)4;1-9(2)10-7-12-8-11(13-10)14-3-5-15-6-4-14;1-9(2)10-7-12-8-11(13-10)14-5-3-4-6-14;1-5-14(6-2)11-8-12-7-10(13-11)9(3)4;1-8(2)9-7-15-11(12-9)13-6-4-3-5-10(13)14;1-8(2)9-5-12-6-10(13-9)14-4-3-11-7-14;1-5-12(6-2)10-11-9(7-13-10)8(3)4;1-7(2)9-11-8(6-12-9)10(3,4)5;1-10(2,3)9-5-7-11(4)8-6-9;1-7(2)8-5-13-9(11-8)12-4-3-10-6-12;1-9(2,3)8-6-11-5-7(4-10)12-8;1-7(2)8-5-10-6-9(11-8)12(3)4;1-9(2,3)7-5-10-6-8(11-7)12-4;1-5-11(4)9-10-8(6-12-9)7(2)3;1-8(2,3)7-6-9-4-5-10-7;1-6-9-7(5-10-6)8(2,3)4;1-5(2)6-3-9-4-7(8)10-6;1-7(2,3)6-4-9-5-8-6/h6-10H,1-5H3;3-9H,1-2H3;10-11H,6-9H2,1-5H3;6-9H,5H2,1-4H3;7-9H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;7-9H,5-6H2,1-4H3;3-8H,1-2H3;3-8H,1-2H3;7-8H,5-6H2,1-4H3;6-7H,1-5H3;9H,5-8H2,1-4H3;3-7H,1-2H3;5-6H,1-3H3;5-7H,1-4H3;5-6H,1-4H3;6-7H,5H2,1-4H3;4-6H,1-3H3;5H,1-4H3;3-5H,1-2H3;4-5H,1-3H3.
What are the key properties of 1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one?
1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one has a molecular weight of 3734.07 g/mol, XLogP of 51.38, 31 rotatable bonds, 0 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-2-ethylbenzene;2-tert-butyl-6-methoxypyrazine;4-tert-butyl-1-methylpiperidine;4-tert-butyl-2-methyl-1,3-thiazole;1-tert-butyl-2-propan-2-ylbenzene;4-tert-butyl-1-propan-2-ylpiperidine;4-tert-butyl-2-propan-2-yl-1,3-thiazole;2-tert-butylpyrazine;6-tert-butylpyrazine-2-carbonitrile;4-tert-butyl-1,3-thiazole;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-6-propan-2-ylpyrazin-2-amine;N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;N,N-dimethyl-6-propan-2-ylpyrazin-2-amine;N-ethyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine;2-imidazol-1-yl-6-propan-2-ylpyrazine;2-imidazol-1-yl-4-propan-2-yl-1,3-thiazole;4-(6-propan-2-ylpyrazin-2-yl)morpholine;1-(6-propan-2-ylpyrazin-2-yl)pyridin-2-one;2-propan-2-yl-6-pyrrolidin-1-ylpyrazine;1-(4-propan-2-yl-1,3-thiazol-2-yl)pyridin-2-one is sourced from PubChem (CID 159849775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).