N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;4-(3,3-dimethylbutyl)-1-propylpiperidine;2-(3,3-dimethylbutyl)pyridine;1-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;tris(1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine);1-methyl-4-[(2-methylpropan-2-yl)oxy]piperidine;(2-methylpropan-2-yl)oxycyclohexane;4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine;1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethanone;1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidine;(2-methylpropan-2-yl)oxymethylcyclohexane;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yl-2-pyrrol-1-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole
C167H320N18O13S3 — CID 159993483
Data last refreshed: (MolForge compound catalog, from PubChem)
About N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;4-(3,3-dimethylbutyl)-1-propylpiperidine;2-(3,3-dimethylbutyl)pyridine;1-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;tris(1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine);1-methyl-4-[(2-methylpropan-2-yl)oxy]piperidine;(2-methylpropan-2-yl)oxycyclohexane;4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine;1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethanone;1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidine;(2-methylpropan-2-yl)oxymethylcyclohexane;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yl-2-pyrrol-1-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole
N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;4-(3,3-dimethylbutyl)-1-propylpiperidine;2-(3,3-dimethylbutyl)pyridine;1-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;tris(1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine);1-methyl-4-[(2-methylpropan-2-yl)oxy]piperidine;(2-methylpropan-2-yl)oxycyclohexane;4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine;1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethanone;1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidine;(2-methylpropan-2-yl)oxymethylcyclohexane;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yl-2-pyrrol-1-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole (PubChem CID 159993483) has the molecular formula C167H320N18O13S3 and a molecular weight of 2884.71 g/mol. Its IUPAC name is N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;4-(3,3-dimethylbutyl)-1-propylpiperidine;2-(3,3-dimethylbutyl)pyridine;1-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;tris(1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine);1-methyl-4-[(2-methylpropan-2-yl)oxy]piperidine;(2-methylpropan-2-yl)oxycyclohexane;4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine;1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethanone;1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidine;(2-methylpropan-2-yl)oxymethylcyclohexane;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yl-2-pyrrol-1-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole.
Molecular Properties
| Compound Name | N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;4-(3,3-dimethylbutyl)-1-propylpiperidine;2-(3,3-dimethylbutyl)pyridine;1-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;tris(1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine);1-methyl-4-[(2-methylpropan-2-yl)oxy]piperidine;(2-methylpropan-2-yl)oxycyclohexane;4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine;1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethanone;1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidine;(2-methylpropan-2-yl)oxymethylcyclohexane;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yl-2-pyrrol-1-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole |
|---|---|
| PubChem CID | 159993483 |
| Molecular Formula | C167H320N18O13S3 |
| Molecular Weight | 2884.71 g/mol |
| Exact Mass | 2882.41 |
| IUPAC Name | N,N-diethyl-4-propan-2-yl-1,3-thiazol-2-amine;4-(3,3-dimethylbutyl)-1-propylpiperidine;2-(3,3-dimethylbutyl)pyridine;1-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;tris(1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine);1-methyl-4-[(2-methylpropan-2-yl)oxy]piperidine;(2-methylpropan-2-yl)oxycyclohexane;4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine;1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethanone;1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidine;(2-methylpropan-2-yl)oxymethylcyclohexane;2-[(2-methylpropan-2-yl)oxy]pyridine;4-propan-2-yl-2-pyrrol-1-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole |
| SMILES | CC(=O)N1CCN(CCOC(C)(C)C)CC1.CC(C)(C)CCc1ccccn1.CC(C)(C)OC1CCCCC1.CC(C)(C)OCC1CCCCC1.CC(C)(C)OCCN1CCCC1.CC(C)(C)OCCN1CCOCC1.CC(C)(C)Oc1ccccn1.CC(C)c1csc(-n2cccc2)n1.CC(C)c1cscn1.CCCN1CCC(CCC(C)(C)C)CC1.CCN(CC)c1nc(C(C)C)cs1.CN1CCC(COC(C)(C)C)CC1.CN1CCC(COC(C)(C)C)CC1.CN1CCC(COC(C)(C)C)CC1.CN1CCC(OC(C)(C)C)CC1.CN1CCN(CCOC(C)(C)C)CC1 |
| InChI | InChI=1S/C14H29N.C12H24N2O2.C11H24N2O.3C11H23NO.C11H17N.C11H22O.C10H12N2S.C10H18N2S.C10H21NO2.2C10H21NO.C10H20O.C9H13NO.C6H9NS/c1-5-10-15-11-7-13(8-12-15)6-9-14(2,3)4;1-11(15)14-7-5-13(6-8-14)9-10-16-12(2,3)4;1-11(2,3)14-10-9-13-7-5-12(4)6-8-13;3*1-11(2,3)13-9-10-5-7-12(4)8-6-10;1-11(2,3)8-7-10-6-4-5-9-12-10;1-11(2,3)12-9-10-7-5-4-6-8-10;1-8(2)9-7-13-10(11-9)12-5-3-4-6-12;1-5-12(6-2)10-11-9(7-13-10)8(3)4;1-10(2,3)13-9-6-11-4-7-12-8-5-11;1-10(2,3)12-9-5-7-11(4)8-6-9;1-10(2,3)12-9-8-11-6-4-5-7-11;1-10(2,3)11-9-7-5-4-6-8-9;1-9(2,3)11-8-6-4-5-7-10-8;1-5(2)6-3-8-4-7-6/h13H,5-12H2,1-4H3;5-10H2,1-4H3;5-10H2,1-4H3;3*10H,5-9H2,1-4H3;4-6,9H,7-8H2,1-3H3;10H,4-9H2,1-3H3;3-8H,1-2H3;7-8H,5-6H2,1-4H3;4-9H2,1-3H3;9H,5-8H2,1-4H3;4-9H2,1-3H3;9H,4-8H2,1-3H3;4-7H,1-3H3;3-5H,1-2H3 |
| InChIKey | OHGAVBPTDUAVQY-UHFFFAOYSA-N |
| XLogP | 37.58 |
| TPSA | 236.09 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 33 |
| Rotatable Bonds | 36 |
| Heavy Atoms | 201 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2884.71 |
| LogP ≤ 5 | 37.58 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 33 |
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Sources
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