C266H460F2N26O18 — CID 157261969
bis(N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine);N-tert-butyl-3-(5-tert-butylpyrazin-2-yl)oxycyclobutan-1-amine;N-tert-butyl-1-(5-tert-butyl-2-pyridinyl)azetidin-3-amine;N-tert-butyl-1-(4-tert-butyl-2-pyridinyl)pyrrolidin-3-amine;bis(N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;N-tert-butyl-1-[5-(2,2-dimethylpropoxy)-2-pyridinyl]azetidin-3-amine;N-tert-butyl-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;N-[2-[3-[2-(2,2-dimethylpropoxy)ethoxy]cyclobutyl]oxyethyl]-2-methylpropan-2-amine;ethane (PubChem CID 157261969) has the molecular formula C266H460F2N26O18 and a molecular weight of 4348.77 g/mol. Its IUPAC name is bis(N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine);N-tert-butyl-3-(5-tert-butylpyrazin-2-yl)oxycyclobutan-1-amine;N-tert-butyl-1-(5-tert-butyl-2-pyridinyl)azetidin-3-amine;N-tert-butyl-1-(4-tert-butyl-2-pyridinyl)pyrrolidin-3-amine;bis(N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;N-tert-butyl-1-[5-(2,2-dimethylpropoxy)-2-pyridinyl]azetidin-3-amine;N-tert-butyl-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;N-[2-[3-[2-(2,2-dimethylpropoxy)ethoxy]cyclobutyl]oxyethyl]-2-methylpropan-2-amine;ethane.
| Compound Name | bis(N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine);N-tert-butyl-3-(5-tert-butylpyrazin-2-yl)oxycyclobutan-1-amine;N-tert-butyl-1-(5-tert-butyl-2-pyridinyl)azetidin-3-amine;N-tert-butyl-1-(4-tert-butyl-2-pyridinyl)pyrrolidin-3-amine;bis(N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;N-tert-butyl-1-[5-(2,2-dimethylpropoxy)-2-pyridinyl]azetidin-3-amine;N-tert-butyl-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;N-[2-[3-[2-(2,2-dimethylpropoxy)ethoxy]cyclobutyl]oxyethyl]-2-methylpropan-2-amine;ethane |
|---|---|
| PubChem CID | 157261969 |
| Molecular Formula | C266H460F2N26O18 |
| Molecular Weight | 4348.77 g/mol |
| Exact Mass | 4345.58 |
| IUPAC Name | bis(N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine);N-tert-butyl-3-(5-tert-butylpyrazin-2-yl)oxycyclobutan-1-amine;N-tert-butyl-1-(5-tert-butyl-2-pyridinyl)azetidin-3-amine;N-tert-butyl-1-(4-tert-butyl-2-pyridinyl)pyrrolidin-3-amine;bis(N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;N-tert-butyl-1-[5-(2,2-dimethylpropoxy)-2-pyridinyl]azetidin-3-amine;N-tert-butyl-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;N-[2-[3-[2-(2,2-dimethylpropoxy)ethoxy]cyclobutyl]oxyethyl]-2-methylpropan-2-amine;ethane |
| SMILES | CC.CC.CC(C)(C)CCCC(F)(F)CCOC(C)(C)C.CC(C)(C)CCc1ccnc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)CCc1ccnc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)COCCOC1CC(OCCNC(C)(C)C)C1.CC(C)(C)COc1ccc(N2CC(NC(C)(C)C)C2)nc1.CC(C)(C)COc1ccc(OC2CC(NC(C)(C)C)C2)nc1.CC(C)(C)COc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)COc1ccnc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)Cc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)NC1CC(Oc2cccc(C(C)(C)C)c2)C1.CC(C)(C)NC1CC(Oc2cccc(C(C)(C)C)c2)C1.CC(C)(C)NC1CC(Oc2cnc(C(C)(C)C)cn2)C1.CC(C)(C)NC1CCN(c2cc(C(C)(C)C)ccn2)C1.CC(C)(C)NC1CN(c2ccc(C(C)(C)C)cn2)C1.C[C@@H](CNC(C)(C)C)Oc1cccc(C(C)(C)C)c1 |
| InChI | InChI=1S/2C19H32N2O.C19H31NO2.C19H31NO.2C18H30N2O2.2C18H29NO.C17H29N3O.C17H29N3.C17H35NO3.C17H29NO.C16H27N3O.C16H27N3.C14H28F2O.2C2H6/c2*1-18(2,3)9-7-14-8-10-20-17(11-14)22-16-12-15(13-16)21-19(4,5)6;1-18(2,3)13-21-15-8-7-9-16(12-15)22-17-10-14(11-17)20-19(4,5)6;1-18(2,3)13-14-8-7-9-16(10-14)21-17-11-15(12-17)20-19(4,5)6;1-17(2,3)12-21-14-7-8-19-16(11-14)22-15-9-13(10-15)20-18(4,5)6;1-17(2,3)12-21-14-7-8-16(19-11-14)22-15-9-13(10-15)20-18(4,5)6;2*1-17(2,3)13-8-7-9-15(10-13)20-16-11-14(12-16)19-18(4,5)6;1-16(2,3)12-21-14-7-8-15(18-9-14)20-10-13(11-20)19-17(4,5)6;1-16(2,3)13-7-9-18-15(11-13)20-10-8-14(12-20)19-17(4,5)6;1-16(2,3)13-19-9-10-21-15-11-14(12-15)20-8-7-18-17(4,5)6;1-13(12-18-17(5,6)7)19-15-10-8-9-14(11-15)16(2,3)4;1-15(2,3)13-9-18-14(10-17-13)20-12-7-11(8-12)19-16(4,5)6;1-15(2,3)12-7-8-14(17-9-12)19-10-13(11-19)18-16(4,5)6;1-12(2,3)8-7-9-14(15,16)10-11-17-13(4,5)6;2*1-2/h2*8,10-11,15-16,21H,7,9,12-13H2,1-6H3;7-9,12,14,17,20H,10-11,13H2,1-6H3;7-10,15,17,20H,11-13H2,1-6H3;2*7-8,11,13,15,20H,9-10,12H2,1-6H3;2*7-10,14,16,19H,11-12H2,1-6H3;7-9,13,19H,10-12H2,1-6H3;7,9,11,14,19H,8,10,12H2,1-6H3;14-15,18H,7-13H2,1-6H3;8-11,13,18H,12H2,1-7H3;9-12,19H,7-8H2,1-6H3;7-9,13,18H,10-11H2,1-6H3;7-11H2,1-6H3;2*1-2H3/t;;;;;;;;;;;13-;;;;;/m...........0...../s1 |
| InChIKey | AXOJFSVPAOSRLN-CYZJRYBCSA-N |
| XLogP | 60.57 |
| TPSA | 460.29 Ų |
| H-Bond Donors | 14 |
| H-Bond Acceptors | 44 |
| Rotatable Bonds | 65 |
| Heavy Atoms | 312 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4348.77 |
| LogP ≤ 5 | 60.57 |
| H-Bond Donors ≤ 5 | 14 |
| H-Bond Acceptors ≤ 10 | 44 |