N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane

C295H506N24O21S — CID 158527136

IUPACN-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane
SMILESCC.CC.CC(C)(C)CCCOC1CCN(CCC(C)(C)C)CC1.CC(C)(C)CCCS(=O)(=O)c1ccc(OCC(C)(C)C)cc1.CC(C)(C)CCc1ccc(OC2CC(NC(C)(C)C)C2)nc1.CC(C)(C)CCc1ccc(OC2CC(NC(C)(C)C)C2)nc1.CC(C)(C)CCc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)CCc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)CCc1ccnc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)COc1ccc(OC2CC(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)Cc1ccc(OC2CC(NC(C)(C)C)C2)cc1.CC(C)(C)Cc1ccc(OC2CC(NC(C)(C)C)C2)cc1.CC(C)(C)NC1CC(Oc2cc(C(C)(C)C)ccn2)C1.CC(C)(C)NCCCOc1ccc(C(C)(C)C)nc1.C[C@@H](CNC(C)(C)C)Oc1cc(C(C)(C)C)ccn1.C[C@H](CNC(C)(C)C)Oc1cc(C(C)(C)C)ccn1
InChIInChI=1S/2C20H33NO.3C19H32N2O.C19H31NO2.2C19H31NO.2C18H30N2O2.C18H37NO.C18H30O3S.C17H28N2O.3C16H28N2O.2C2H6/c2*1-19(2,3)11-10-15-8-7-9-17(12-15)22-18-13-16(14-18)21-20(4,5)6;1-18(2,3)9-7-14-8-10-20-17(11-14)22-16-12-15(13-16)21-19(4,5)6;2*1-18(2,3)10-9-14-7-8-17(20-13-14)22-16-11-15(12-16)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;2*1-18(2,3)13-14-7-9-16(10-8-14)21-17-11-15(12-17)20-19(4,5)6;2*1-17(2,3)12-21-14-7-8-16(19-11-14)22-15-9-13(10-15)20-18(4,5)6;1-17(2,3)10-7-15-20-16-8-12-19(13-9-16)14-11-18(4,5)6;1-17(2,3)12-7-13-22(19,20)16-10-8-15(9-11-16)21-14-18(4,5)6;1-16(2,3)12-7-8-18-15(9-12)20-14-10-13(11-14)19-17(4,5)6;2*1-12(11-18-16(5,6)7)19-14-10-13(8-9-17-14)15(2,3)4;1-15(2,3)14-9-8-13(12-17-14)19-11-7-10-18-16(4,5)6;2*1-2/h2*7-9,12,16,18,21H,10-11,13-14H2,1-6H3;8,10-11,15-16,21H,7,9,12-13H2,1-6H3;2*7-8,13,15-16,21H,9-12H2,1-6H3;7-9,12,14,17,20H,10-11,13H2,1-6H3;2*7-10,15,17,20H,11-13H2,1-6H3;2*7-8,11,13,15,20H,9-10,12H2,1-6H3;16H,7-15H2,1-6H3;8-11H,7,12-14H2,1-6H3;7-9,13-14,19H,10-11H2,1-6H3;2*8-10,12,18H,11H2,1-7H3;8-9,12,18H,7,10-11H2,1-6H3;2*1-2H3/t;;;;;;;;;;;;;2*12-;;;/m.............10.../s1
InChIKeyHMXOAUAXBASKRF-VRYXNKAVSA-N
MW4757.51 g/mol
LogP69.94
Rot. Bonds76

About N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane

N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane (PubChem CID 158527136) has the molecular formula C295H506N24O21S and a molecular weight of 4757.51 g/mol. Its IUPAC name is N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane.

Molecular Properties

Compound NameN-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane
PubChem CID158527136
Molecular FormulaC295H506N24O21S
Molecular Weight4757.51 g/mol
Exact Mass4753.90
IUPAC NameN-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane
SMILESCC.CC.CC(C)(C)CCCOC1CCN(CCC(C)(C)C)CC1.CC(C)(C)CCCS(=O)(=O)c1ccc(OCC(C)(C)C)cc1.CC(C)(C)CCc1ccc(OC2CC(NC(C)(C)C)C2)nc1.CC(C)(C)CCc1ccc(OC2CC(NC(C)(C)C)C2)nc1.CC(C)(C)CCc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)CCc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)CCc1ccnc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)COc1ccc(OC2CC(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)Cc1ccc(OC2CC(NC(C)(C)C)C2)cc1.CC(C)(C)Cc1ccc(OC2CC(NC(C)(C)C)C2)cc1.CC(C)(C)NC1CC(Oc2cc(C(C)(C)C)ccn2)C1.CC(C)(C)NCCCOc1ccc(C(C)(C)C)nc1.C[C@@H](CNC(C)(C)C)Oc1cc(C(C)(C)C)ccn1.C[C@H](CNC(C)(C)C)Oc1cc(C(C)(C)C)ccn1
InChIInChI=1S/2C20H33NO.3C19H32N2O.C19H31NO2.2C19H31NO.2C18H30N2O2.C18H37NO.C18H30O3S.C17H28N2O.3C16H28N2O.2C2H6/c2*1-19(2,3)11-10-15-8-7-9-17(12-15)22-18-13-16(14-18)21-20(4,5)6;1-18(2,3)9-7-14-8-10-20-17(11-14)22-16-12-15(13-16)21-19(4,5)6;2*1-18(2,3)10-9-14-7-8-17(20-13-14)22-16-11-15(12-16)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;2*1-18(2,3)13-14-7-9-16(10-8-14)21-17-11-15(12-17)20-19(4,5)6;2*1-17(2,3)12-21-14-7-8-16(19-11-14)22-15-9-13(10-15)20-18(4,5)6;1-17(2,3)10-7-15-20-16-8-12-19(13-9-16)14-11-18(4,5)6;1-17(2,3)12-7-13-22(19,20)16-10-8-15(9-11-16)21-14-18(4,5)6;1-16(2,3)12-7-8-18-15(9-12)20-14-10-13(11-14)19-17(4,5)6;2*1-12(11-18-16(5,6)7)19-14-10-13(8-9-17-14)15(2,3)4;1-15(2,3)14-9-8-13(12-17-14)19-11-7-10-18-16(4,5)6;2*1-2/h2*7-9,12,16,18,21H,10-11,13-14H2,1-6H3;8,10-11,15-16,21H,7,9,12-13H2,1-6H3;2*7-8,13,15-16,21H,9-12H2,1-6H3;7-9,12,14,17,20H,10-11,13H2,1-6H3;2*7-10,15,17,20H,11-13H2,1-6H3;2*7-8,11,13,15,20H,9-10,12H2,1-6H3;16H,7-15H2,1-6H3;8-11H,7,12-14H2,1-6H3;7-9,13-14,19H,10-11H2,1-6H3;2*8-10,12,18H,11H2,1-7H3;8-9,12,18H,7,10-11H2,1-6H3;2*1-2H3/t;;;;;;;;;;;;;2*12-;;;/m.............10.../s1
InChIKeyHMXOAUAXBASKRF-VRYXNKAVSA-N
XLogP69.94
TPSA497.18 Ų
H-Bond Donors14
H-Bond Acceptors45
Rotatable Bonds76
Heavy Atoms341
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004757.51
LogP ≤ 569.94
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1045

Analyze N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane?
The IUPAC name of N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane (CID 158527136) is N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane.
What is the SMILES notation for N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane?
The canonical SMILES for N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane is CC.CC.CC(C)(C)CCCOC1CCN(CCC(C)(C)C)CC1.CC(C)(C)CCCS(=O)(=O)c1ccc(OCC(C)(C)C)cc1.CC(C)(C)CCc1ccc(OC2CC(NC(C)(C)C)C2)nc1.CC(C)(C)CCc1ccc(OC2CC(NC(C)(C)C)C2)nc1.CC(C)(C)CCc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)CCc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)CCc1ccnc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)COc1ccc(OC2CC(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)Cc1ccc(OC2CC(NC(C)(C)C)C2)cc1.CC(C)(C)Cc1ccc(OC2CC(NC(C)(C)C)C2)cc1.CC(C)(C)NC1CC(Oc2cc(C(C)(C)C)ccn2)C1.CC(C)(C)NCCCOc1ccc(C(C)(C)C)nc1.C[C@@H](CNC(C)(C)C)Oc1cc(C(C)(C)C)ccn1.C[C@H](CNC(C)(C)C)Oc1cc(C(C)(C)C)ccn1.
What is the InChIKey of N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane?
The InChIKey is HMXOAUAXBASKRF-VRYXNKAVSA-N. The full InChI is InChI=1S/2C20H33NO.3C19H32N2O.C19H31NO2.2C19H31NO.2C18H30N2O2.C18H37NO.C18H30O3S.C17H28N2O.3C16H28N2O.2C2H6/c2*1-19(2,3)11-10-15-8-7-9-17(12-15)22-18-13-16(14-18)21-20(4,5)6;1-18(2,3)9-7-14-8-10-20-17(11-14)22-16-12-15(13-16)21-19(4,5)6;2*1-18(2,3)10-9-14-7-8-17(20-13-14)22-16-11-15(12-16)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;2*1-18(2,3)13-14-7-9-16(10-8-14)21-17-11-15(12-17)20-19(4,5)6;2*1-17(2,3)12-21-14-7-8-16(19-11-14)22-15-9-13(10-15)20-18(4,5)6;1-17(2,3)10-7-15-20-16-8-12-19(13-9-16)14-11-18(4,5)6;1-17(2,3)12-7-13-22(19,20)16-10-8-15(9-11-16)21-14-18(4,5)6;1-16(2,3)12-7-8-18-15(9-12)20-14-10-13(11-14)19-17(4,5)6;2*1-12(11-18-16(5,6)7)19-14-10-13(8-9-17-14)15(2,3)4;1-15(2,3)14-9-8-13(12-17-14)19-11-7-10-18-16(4,5)6;2*1-2/h2*7-9,12,16,18,21H,10-11,13-14H2,1-6H3;8,10-11,15-16,21H,7,9,12-13H2,1-6H3;2*7-8,13,15-16,21H,9-12H2,1-6H3;7-9,12,14,17,20H,10-11,13H2,1-6H3;2*7-10,15,17,20H,11-13H2,1-6H3;2*7-8,11,13,15,20H,9-10,12H2,1-6H3;16H,7-15H2,1-6H3;8-11H,7,12-14H2,1-6H3;7-9,13-14,19H,10-11H2,1-6H3;2*8-10,12,18H,11H2,1-7H3;8-9,12,18H,7,10-11H2,1-6H3;2*1-2H3/t;;;;;;;;;;;;;2*12-;;;/m.............10.../s1.
What are the key properties of N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane?
N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane has a molecular weight of 4757.51 g/mol, XLogP of 69.94, 76 rotatable bonds, 14 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(4-tert-butyl-2-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;1-(3,3-dimethylbutyl)-4-(4,4-dimethylpentoxy)piperidine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;ethane is sourced from PubChem (CID 158527136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).