N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane

C258H440F2N20O16 — CID 159642496

IUPACN-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane
SMILESCC.CC.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)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)Cc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)NC1CC(Oc2ccc3oc(C(C)(C)C)cc3c2)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.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/C20H29NO2.2C19H32N2O.C19H31NO2.2C19H31NO.C18H30N2O2.2C18H29NO.C17H29N3.2C17H29NO.C16H27N3O.C14H28F2O.4C2H6/c1-19(2,3)18-10-13-9-15(7-8-17(13)23-18)22-16-11-14(12-16)21-20(4,5)6;2*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;2*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;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)13-7-9-18-15(11-13)20-10-8-14(12-20)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;1-15(2,3)13-9-18-14(10-17-13)20-12-7-11(8-12)19-16(4,5)6;1-12(2,3)8-7-9-14(15,16)10-11-17-13(4,5)6;4*1-2/h7-10,14,16,21H,11-12H2,1-6H3;2*8,10-11,15-16,21H,7,9,12-13H2,1-6H3;7-9,12,14,17,20H,10-11,13H2,1-6H3;2*7-10,15,17,20H,11-13H2,1-6H3;7-8,11,13,15,20H,9-10,12H2,1-6H3;2*7-10,14,16,19H,11-12H2,1-6H3;7,9,11,14,19H,8,10,12H2,1-6H3;2*8-11,13,18H,12H2,1-7H3;9-12,19H,7-8H2,1-6H3;7-11H2,1-6H3;4*1-2H3/t;;;;;;;;;;2*13-;;;;;;/m..........10....../s1
InChIKeyMQNLMPCKAHWDID-IQIVLFEASA-N
MW4116.48 g/mol
LogP63.51
Rot. Bonds56

About N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane

N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane (PubChem CID 159642496) has the molecular formula C258H440F2N20O16 and a molecular weight of 4116.48 g/mol. Its IUPAC name is N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane.

Molecular Properties

Compound NameN-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane
PubChem CID159642496
Molecular FormulaC258H440F2N20O16
Molecular Weight4116.48 g/mol
Exact Mass4113.42
IUPAC NameN-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane
SMILESCC.CC.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)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)Cc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)NC1CC(Oc2ccc3oc(C(C)(C)C)cc3c2)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.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/C20H29NO2.2C19H32N2O.C19H31NO2.2C19H31NO.C18H30N2O2.2C18H29NO.C17H29N3.2C17H29NO.C16H27N3O.C14H28F2O.4C2H6/c1-19(2,3)18-10-13-9-15(7-8-17(13)23-18)22-16-11-14(12-16)21-20(4,5)6;2*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;2*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;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)13-7-9-18-15(11-13)20-10-8-14(12-20)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;1-15(2,3)13-9-18-14(10-17-13)20-12-7-11(8-12)19-16(4,5)6;1-12(2,3)8-7-9-14(15,16)10-11-17-13(4,5)6;4*1-2/h7-10,14,16,21H,11-12H2,1-6H3;2*8,10-11,15-16,21H,7,9,12-13H2,1-6H3;7-9,12,14,17,20H,10-11,13H2,1-6H3;2*7-10,15,17,20H,11-13H2,1-6H3;7-8,11,13,15,20H,9-10,12H2,1-6H3;2*7-10,14,16,19H,11-12H2,1-6H3;7,9,11,14,19H,8,10,12H2,1-6H3;2*8-11,13,18H,12H2,1-7H3;9-12,19H,7-8H2,1-6H3;7-11H2,1-6H3;4*1-2H3/t;;;;;;;;;;2*13-;;;;;;/m..........10....../s1
InChIKeyMQNLMPCKAHWDID-IQIVLFEASA-N
XLogP63.51
TPSA388.56 Ų
H-Bond Donors13
H-Bond Acceptors36
Rotatable Bonds56
Heavy Atoms296
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004116.48
LogP ≤ 563.51
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1036

Analyze N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane with MolForge

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Launch Full Analysis

Related Compounds

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
CID 157261969
CID 158308200
CID 158308200
CID 161435044
CID 161435044
CID 167657383
CID 167657383
bis(N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine);bis(N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine);N-tert-butyl-3-[(5-tert-butyl-2-pyridinyl)oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);2-tert-butyl-6-(5,5-dimethylhexan-2-yloxy)-1-benzofuran;bis(N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine);N-tert-butyl-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(2-tert-butyl-6-[3-(2,2-dimethylpropyl)cyclobutyl]oxy-1-benzofuran);bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);(3S)-N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;ethane
CID 157347544
CID 157348773
CID 157348773
CID 157442502
CID 157442502
CID 157585911
CID 157585911
CID 157677847
CID 157677847
N-[2-[(2-tert-butyl-1-benzofuran-5-yl)oxy]ethyl]-2-methylpropan-2-amine;N-[(2S)-2-[(2-tert-butyl-1-benzofuran-5-yl)oxy]propyl]-2-methylpropan-2-amine;N-[(2R)-2-[(2-tert-butyl-1-benzofuran-5-yl)oxy]propyl]-2-methylpropan-2-amine;2-tert-butyl-5-(5,5-dimethylhexoxy)-1-benzofuran;2-tert-butyl-6-(5,5-dimethylhexoxy)imidazo[1,2-a]pyridine;N-[2-(2-tert-butylimidazo[1,2-a]pyridin-6-yl)oxyethyl]-2-methylpropan-2-amine;N-[2-(3-tert-butylphenoxy)ethyl]-2-methylpropan-2-amine;N-[2-[(6-tert-butyl-2-pyridinyl)oxy]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxymethyl)-4-[3-(2,2-dimethylpropyl)phenoxy]benzene;N-[2-[6-(2,2-dimethylpropyl)-1-benzofuran-2-yl]ethyl]-2-methylpropan-2-amine;2-(2,2-dimethylpropyl)-5-[(3R)-3-(2,2-dimethylpropyl)pyrrolidin-1-yl]pyridine;N-[2-[[6-(2,2-dimethylpropyl)-3-pyridinyl]oxy]ethyl]-2-methylpropan-2-amine
CID 157688136
CID 157763939
CID 157763939
bis(N-tert-butyl-3-(3-tert-butylphenoxy)cyclobutan-1-amine);bis(N-tert-butyl-3-[[4-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);1-tert-butyl-4-[[1-(4,4-dimethylpentyl)azetidin-3-yl]methyl]piperazine;N-tert-butyl-3-[3-(2,2-dimethylpropoxy)phenoxy]cyclobutan-1-amine;N-tert-butyl-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;2-tert-butyl-5-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methoxy]pyrazine;2-tert-butyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine;4-tert-butyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperidine;N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;ethane
CID 157792198

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane?
The IUPAC name of N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane (CID 159642496) is N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane.
What is the SMILES notation for N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane?
The canonical SMILES for N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane is CC.CC.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)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)Cc1cccc(OC2CC(NC(C)(C)C)C2)c1.CC(C)(C)NC1CC(Oc2ccc3oc(C(C)(C)C)cc3c2)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.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 N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane?
The InChIKey is MQNLMPCKAHWDID-IQIVLFEASA-N. The full InChI is InChI=1S/C20H29NO2.2C19H32N2O.C19H31NO2.2C19H31NO.C18H30N2O2.2C18H29NO.C17H29N3.2C17H29NO.C16H27N3O.C14H28F2O.4C2H6/c1-19(2,3)18-10-13-9-15(7-8-17(13)23-18)22-16-11-14(12-16)21-20(4,5)6;2*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;2*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;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)13-7-9-18-15(11-13)20-10-8-14(12-20)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;1-15(2,3)13-9-18-14(10-17-13)20-12-7-11(8-12)19-16(4,5)6;1-12(2,3)8-7-9-14(15,16)10-11-17-13(4,5)6;4*1-2/h7-10,14,16,21H,11-12H2,1-6H3;2*8,10-11,15-16,21H,7,9,12-13H2,1-6H3;7-9,12,14,17,20H,10-11,13H2,1-6H3;2*7-10,15,17,20H,11-13H2,1-6H3;7-8,11,13,15,20H,9-10,12H2,1-6H3;2*7-10,14,16,19H,11-12H2,1-6H3;7,9,11,14,19H,8,10,12H2,1-6H3;2*8-11,13,18H,12H2,1-7H3;9-12,19H,7-8H2,1-6H3;7-11H2,1-6H3;4*1-2H3/t;;;;;;;;;;2*13-;;;;;;/m..........10....../s1.
What are the key properties of N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane?
N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane has a molecular weight of 4116.48 g/mol, XLogP of 63.51, 56 rotatable bonds, 13 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3-[(2-tert-butyl-1-benzofuran-5-yl)oxy]cyclobutan-1-amine;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-(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-3-[[4-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;bis(N-tert-butyl-3-[3-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine);N-[(2S)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;N-[(2R)-2-(3-tert-butylphenoxy)propyl]-2-methylpropan-2-amine;3,3-difluoro-7,7-dimethyl-1-[(2-methylpropan-2-yl)oxy]octane;ethane is sourced from PubChem (CID 159642496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).