bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane

C309H506N18O19 — CID 161059227

IUPACbis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane
SMILESCC.CC.CC.CC(C)(C)CC1CC(Oc2ccc3cc(C(C)(C)C)oc3c2)C1.CC(C)(C)CC1CC(Oc2ccc3cc(C(C)(C)C)oc3c2)C1.CC(C)(C)CCc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)CN1CCC(OC2CC(NC(C)(C)C)C2)CC1.CC(C)(C)COc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)Cc1ccc(N2CC[C@@H](NC(C)(C)C)C2)cc1.CC(C)(C)Cc1ccc(N2CC[C@H](NC(C)(C)C)C2)cc1.CC(C)(C)Cc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)NC1CC(Oc2cc(C(C)(C)C)ccn2)C1.CC(C)(C)NC1CC(Oc2cc(C(C)(C)C)ccn2)C1.CC(C)(C)NC1CC(Oc2ccc3oc(C(C)(C)C)cc3c2)C1.CC(C)(C)NC1CC(Oc2ccc3oc(C(C)(C)C)cc3c2)C1.CC(C)(C)NC1CC(Oc2cccc(C(C)(C)C)c2)C1.CC(CCC(C)(C)C)Cc1ccc2cc(C(C)(C)C)oc2c1.C[C@@H](CNC(C)(C)C)Oc1cccc(C(C)(C)C)c1.C[C@H](CNC(C)(C)C)Oc1cccc(C(C)(C)C)c1
InChIInChI=1S/2C21H30O2.C21H32O.2C20H29NO2.C20H33NO.2C19H32N2.C19H31NO2.C19H31NO.C18H36N2O.C18H29NO.2C17H28N2O.2C17H29NO.3C2H6/c2*1-20(2,3)13-14-9-17(10-14)22-16-8-7-15-11-19(21(4,5)6)23-18(15)12-16;1-15(10-11-20(2,3)4)12-16-8-9-17-14-19(21(5,6)7)22-18(17)13-16;2*1-19(2,3)18-10-13-9-15(7-8-17(13)23-18)22-16-11-14(12-16)21-20(4,5)6;1-19(2,3)11-10-15-8-7-9-17(12-15)22-18-13-16(14-18)21-20(4,5)6;2*1-18(2,3)13-15-7-9-17(10-8-15)21-12-11-16(14-21)20-19(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)13-20-9-7-15(8-10-20)21-16-11-14(12-16)19-18(4,5)6;1-17(2,3)13-8-7-9-15(10-13)20-16-11-14(12-16)19-18(4,5)6;2*1-16(2,3)12-7-8-18-15(9-12)20-14-10-13(11-14)19-17(4,5)6;2*1-13(12-18-17(5,6)7)19-15-10-8-9-14(11-15)16(2,3)4;3*1-2/h2*7-8,11-12,14,17H,9-10,13H2,1-6H3;8-9,13-15H,10-12H2,1-7H3;2*7-10,14,16,21H,11-12H2,1-6H3;7-9,12,16,18,21H,10-11,13-14H2,1-6H3;2*7-10,16,20H,11-14H2,1-6H3;7-9,12,14,17,20H,10-11,13H2,1-6H3;7-10,15,17,20H,11-13H2,1-6H3;14-16,19H,7-13H2,1-6H3;7-10,14,16,19H,11-12H2,1-6H3;2*7-9,13-14,19H,10-11H2,1-6H3;2*8-11,13,18H,12H2,1-7H3;3*1-2H3/t;;;;;;2*16-;;;;;;;2*13-;;;/m......10......10.../s1
InChIKeyUDEDGWWFUHFSAL-JKNIIABFSA-N
MW4777.55 g/mol
LogP78.30
Rot. Bonds57

About bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane

bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane (PubChem CID 161059227) has the molecular formula C309H506N18O19 and a molecular weight of 4777.55 g/mol. Its IUPAC name is bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane.

Molecular Properties

Compound Namebis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane
PubChem CID161059227
Molecular FormulaC309H506N18O19
Molecular Weight4777.55 g/mol
Exact Mass4773.92
IUPAC Namebis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane
SMILESCC.CC.CC.CC(C)(C)CC1CC(Oc2ccc3cc(C(C)(C)C)oc3c2)C1.CC(C)(C)CC1CC(Oc2ccc3cc(C(C)(C)C)oc3c2)C1.CC(C)(C)CCc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)CN1CCC(OC2CC(NC(C)(C)C)C2)CC1.CC(C)(C)COc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)Cc1ccc(N2CC[C@@H](NC(C)(C)C)C2)cc1.CC(C)(C)Cc1ccc(N2CC[C@H](NC(C)(C)C)C2)cc1.CC(C)(C)Cc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)NC1CC(Oc2cc(C(C)(C)C)ccn2)C1.CC(C)(C)NC1CC(Oc2cc(C(C)(C)C)ccn2)C1.CC(C)(C)NC1CC(Oc2ccc3oc(C(C)(C)C)cc3c2)C1.CC(C)(C)NC1CC(Oc2ccc3oc(C(C)(C)C)cc3c2)C1.CC(C)(C)NC1CC(Oc2cccc(C(C)(C)C)c2)C1.CC(CCC(C)(C)C)Cc1ccc2cc(C(C)(C)C)oc2c1.C[C@@H](CNC(C)(C)C)Oc1cccc(C(C)(C)C)c1.C[C@H](CNC(C)(C)C)Oc1cccc(C(C)(C)C)c1
InChIInChI=1S/2C21H30O2.C21H32O.2C20H29NO2.C20H33NO.2C19H32N2.C19H31NO2.C19H31NO.C18H36N2O.C18H29NO.2C17H28N2O.2C17H29NO.3C2H6/c2*1-20(2,3)13-14-9-17(10-14)22-16-8-7-15-11-19(21(4,5)6)23-18(15)12-16;1-15(10-11-20(2,3)4)12-16-8-9-17-14-19(21(5,6)7)22-18(17)13-16;2*1-19(2,3)18-10-13-9-15(7-8-17(13)23-18)22-16-11-14(12-16)21-20(4,5)6;1-19(2,3)11-10-15-8-7-9-17(12-15)22-18-13-16(14-18)21-20(4,5)6;2*1-18(2,3)13-15-7-9-17(10-8-15)21-12-11-16(14-21)20-19(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)13-20-9-7-15(8-10-20)21-16-11-14(12-16)19-18(4,5)6;1-17(2,3)13-8-7-9-15(10-13)20-16-11-14(12-16)19-18(4,5)6;2*1-16(2,3)12-7-8-18-15(9-12)20-14-10-13(11-14)19-17(4,5)6;2*1-13(12-18-17(5,6)7)19-15-10-8-9-14(11-15)16(2,3)4;3*1-2/h2*7-8,11-12,14,17H,9-10,13H2,1-6H3;8-9,13-15H,10-12H2,1-7H3;2*7-10,14,16,21H,11-12H2,1-6H3;7-9,12,16,18,21H,10-11,13-14H2,1-6H3;2*7-10,16,20H,11-14H2,1-6H3;7-9,12,14,17,20H,10-11,13H2,1-6H3;7-10,15,17,20H,11-13H2,1-6H3;14-16,19H,7-13H2,1-6H3;7-10,14,16,19H,11-12H2,1-6H3;2*7-9,13-14,19H,10-11H2,1-6H3;2*8-11,13,18H,12H2,1-7H3;3*1-2H3/t;;;;;;2*16-;;;;;;;2*13-;;;/m......10......10.../s1
InChIKeyUDEDGWWFUHFSAL-JKNIIABFSA-N
XLogP78.30
TPSA386.81 Ų
H-Bond Donors13
H-Bond Acceptors37
Rotatable Bonds57
Heavy Atoms346
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004777.55
LogP ≤ 578.30
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1037

Analyze bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane?
The IUPAC name of bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane (CID 161059227) is bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane.
What is the SMILES notation for bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane?
The canonical SMILES for bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane is CC.CC.CC.CC(C)(C)CC1CC(Oc2ccc3cc(C(C)(C)C)oc3c2)C1.CC(C)(C)CC1CC(Oc2ccc3cc(C(C)(C)C)oc3c2)C1.CC(C)(C)CCc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)CN1CCC(OC2CC(NC(C)(C)C)C2)CC1.CC(C)(C)COc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)Cc1ccc(N2CC[C@@H](NC(C)(C)C)C2)cc1.CC(C)(C)Cc1ccc(N2CC[C@H](NC(C)(C)C)C2)cc1.CC(C)(C)Cc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)NC1CC(Oc2cc(C(C)(C)C)ccn2)C1.CC(C)(C)NC1CC(Oc2cc(C(C)(C)C)ccn2)C1.CC(C)(C)NC1CC(Oc2ccc3oc(C(C)(C)C)cc3c2)C1.CC(C)(C)NC1CC(Oc2ccc3oc(C(C)(C)C)cc3c2)C1.CC(C)(C)NC1CC(Oc2cccc(C(C)(C)C)c2)C1.CC(CCC(C)(C)C)Cc1ccc2cc(C(C)(C)C)oc2c1.C[C@@H](CNC(C)(C)C)Oc1cccc(C(C)(C)C)c1.C[C@H](CNC(C)(C)C)Oc1cccc(C(C)(C)C)c1.
What is the InChIKey of bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane?
The InChIKey is UDEDGWWFUHFSAL-JKNIIABFSA-N. The full InChI is InChI=1S/2C21H30O2.C21H32O.2C20H29NO2.C20H33NO.2C19H32N2.C19H31NO2.C19H31NO.C18H36N2O.C18H29NO.2C17H28N2O.2C17H29NO.3C2H6/c2*1-20(2,3)13-14-9-17(10-14)22-16-8-7-15-11-19(21(4,5)6)23-18(15)12-16;1-15(10-11-20(2,3)4)12-16-8-9-17-14-19(21(5,6)7)22-18(17)13-16;2*1-19(2,3)18-10-13-9-15(7-8-17(13)23-18)22-16-11-14(12-16)21-20(4,5)6;1-19(2,3)11-10-15-8-7-9-17(12-15)22-18-13-16(14-18)21-20(4,5)6;2*1-18(2,3)13-15-7-9-17(10-8-15)21-12-11-16(14-21)20-19(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)13-20-9-7-15(8-10-20)21-16-11-14(12-16)19-18(4,5)6;1-17(2,3)13-8-7-9-15(10-13)20-16-11-14(12-16)19-18(4,5)6;2*1-16(2,3)12-7-8-18-15(9-12)20-14-10-13(11-14)19-17(4,5)6;2*1-13(12-18-17(5,6)7)19-15-10-8-9-14(11-15)16(2,3)4;3*1-2/h2*7-8,11-12,14,17H,9-10,13H2,1-6H3;8-9,13-15H,10-12H2,1-7H3;2*7-10,14,16,21H,11-12H2,1-6H3;7-9,12,16,18,21H,10-11,13-14H2,1-6H3;2*7-10,16,20H,11-14H2,1-6H3;7-9,12,14,17,20H,10-11,13H2,1-6H3;7-10,15,17,20H,11-13H2,1-6H3;14-16,19H,7-13H2,1-6H3;7-10,14,16,19H,11-12H2,1-6H3;2*7-9,13-14,19H,10-11H2,1-6H3;2*8-11,13,18H,12H2,1-7H3;3*1-2H3/t;;;;;;2*16-;;;;;;;2*13-;;;/m......10......10.../s1.
What are the key properties of bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane?
bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane has a molecular weight of 4777.55 g/mol, XLogP of 78.30, 57 rotatable bonds, 13 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine;bis(N-tert-butyl-3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine);N-tert-butyl-3-[3-(3,3-dimethylbutyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;(3S)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;(3R)-N-tert-butyl-1-[4-(2,2-dimethylpropyl)phenyl]pyrrolidin-3-amine;N-tert-butyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutan-1-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;2-tert-butyl-6-(2,5,5-trimethylhexyl)-1-benzofuran;ethane is sourced from PubChem (CID 161059227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).