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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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

C139H218ClN25O2S3 — CID 167699919

IUPAC1-tert-butyl-2-ethylbenzene;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;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
SMILESCC(C)(C)c1cnccn1.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(N2CCCC2)n1.CC(C)c1cncc(N2CCOCC2)n1.CC(C)c1csc(C(C)C)n1.CC(C)c1cscn1.CCN(CC)c1cncc(C(C)C)n1.CCc1ccccc1C(C)(C)C.CN1CCC(C(C)(C)C)CC1.Cc1nc(C(C)C)cs1
InChIInChI=1S/C13H20.C12H13N3O.C12H25N.C12H18.C11H17N3O.C11H17N3.C11H19N3.C10H12N4.C10H21N.C9H15NS.C8H12N2.C7H9ClN2.C7H11NS.C6H9NS/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)9-5-12-6-10(13-9)14-4-3-11-7-14;1-10(2,3)9-5-7-11(4)8-6-9;1-6(2)8-5-11-9(10-8)7(3)4;1-8(2,3)7-6-9-4-5-10-7;1-5(2)6-3-9-4-7(8)10-6;1-5(2)7-4-9-6(3)8-7;1-5(2)6-3-8-4-7-6/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;9H,5-8H2,1-4H3;5-7H,1-4H3;4-6H,1-3H3;3-5H,1-2H3;4-5H,1-3H3;3-5H,1-2H3
InChIKeyYFLBZZYPNVXDEK-UHFFFAOYSA-N
MW2403.10 g/mol
LogP35.06
Rot. Bonds20

About 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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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

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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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 (PubChem CID 167699919) has the molecular formula C139H218ClN25O2S3 and a molecular weight of 2403.10 g/mol. Its IUPAC name is 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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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.

Molecular Properties

Compound Name1-tert-butyl-2-ethylbenzene;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;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
PubChem CID167699919
Molecular FormulaC139H218ClN25O2S3
Molecular Weight2403.10 g/mol
Exact Mass2400.66
IUPAC Name1-tert-butyl-2-ethylbenzene;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;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
SMILESCC(C)(C)c1cnccn1.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(N2CCCC2)n1.CC(C)c1cncc(N2CCOCC2)n1.CC(C)c1csc(C(C)C)n1.CC(C)c1cscn1.CCN(CC)c1cncc(C(C)C)n1.CCc1ccccc1C(C)(C)C.CN1CCC(C(C)(C)C)CC1.Cc1nc(C(C)C)cs1
InChIInChI=1S/C13H20.C12H13N3O.C12H25N.C12H18.C11H17N3O.C11H17N3.C11H19N3.C10H12N4.C10H21N.C9H15NS.C8H12N2.C7H9ClN2.C7H11NS.C6H9NS/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)9-5-12-6-10(13-9)14-4-3-11-7-14;1-10(2,3)9-5-7-11(4)8-6-9;1-6(2)8-5-11-9(10-8)7(3)4;1-8(2,3)7-6-9-4-5-10-7;1-5(2)6-3-9-4-7(8)10-6;1-5(2)7-4-9-6(3)8-7;1-5(2)6-3-8-4-7-6/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;9H,5-8H2,1-4H3;5-7H,1-4H3;4-6H,1-3H3;3-5H,1-2H3;4-5H,1-3H3;3-5H,1-2H3
InChIKeyYFLBZZYPNVXDEK-UHFFFAOYSA-N
XLogP35.06
TPSA284.38 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds20
Heavy Atoms170
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002403.10
LogP ≤ 535.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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 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;1-tert-butyl-2-fluorobenzene;1-tert-butyl-3-fluorobenzene;1-tert-butyl-4-methylbenzene;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;1-(6-tert-butylpyrazin-2-yl)pyridin-2-one;2-tert-butyl-6-pyrrolidin-1-ylpyrazine;4-tert-butyl-1,3-thiazole
CID 157882564
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-3-fluorobenzene;1-tert-butyl-4-fluorobenzene;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;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 158438996
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
2-tert-butyl-1,3-difluorobenzene;1-tert-butyl-3,5-dimethylbenzene;2-tert-butyl-1,3-dimethylbenzene;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-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 159020500
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;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 159254017
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
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

Frequently Asked Questions

What is the IUPAC name of 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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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?
The IUPAC name of 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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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 167699919) is 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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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.
What is the SMILES notation for 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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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?
The canonical SMILES for 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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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 is CC(C)(C)c1cnccn1.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(N2CCCC2)n1.CC(C)c1cncc(N2CCOCC2)n1.CC(C)c1csc(C(C)C)n1.CC(C)c1cscn1.CCN(CC)c1cncc(C(C)C)n1.CCc1ccccc1C(C)(C)C.CN1CCC(C(C)(C)C)CC1.Cc1nc(C(C)C)cs1.
What is the InChIKey of 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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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?
The InChIKey is YFLBZZYPNVXDEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20.C12H13N3O.C12H25N.C12H18.C11H17N3O.C11H17N3.C11H19N3.C10H12N4.C10H21N.C9H15NS.C8H12N2.C7H9ClN2.C7H11NS.C6H9NS/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)9-5-12-6-10(13-9)14-4-3-11-7-14;1-10(2,3)9-5-7-11(4)8-6-9;1-6(2)8-5-11-9(10-8)7(3)4;1-8(2,3)7-6-9-4-5-10-7;1-5(2)6-3-9-4-7(8)10-6;1-5(2)7-4-9-6(3)8-7;1-5(2)6-3-8-4-7-6/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;9H,5-8H2,1-4H3;5-7H,1-4H3;4-6H,1-3H3;3-5H,1-2H3;4-5H,1-3H3;3-5H,1-2H3.
What are the key properties of 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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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?
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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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 has a molecular weight of 2403.10 g/mol, XLogP of 35.06, 20 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 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-tert-butylpyrazine;2-chloro-6-propan-2-ylpyrazine;N,N-diethyl-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 is sourced from PubChem (CID 167699919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).