4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane)

C275H465N23O19S — CID 158570647

IUPAC4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane)
SMILESCC(C)(C)COCC#CC#CCNC(C)(C)C.CC(C)(C)COCCC(=O)N1CCN(c2ccc(CNC(C)(C)C)cc2)CC1.CC(C)(C)COCCN1CCC(c2ccc(CNC(C)(C)C)cc2)CC1.CC(C)(C)COCCN1CCN(c2ccc(CNC(C)(C)C)cc2)CC1.CC(C)(C)NCC#CC#CCOC(C)(C)C.CC(C)(C)NCCCOc1ccc(C(C)(C)C)nc1.CC(C)C.CC(C)C.CC(C)C.CC(NC(C)(C)C)c1ccc(-c2ccn(CCOCC(C)(C)C)c(=O)c2)cc1.CC(NC(C)(C)C)c1ccc(-c2ncc(CCOCC(C)(C)C)cn2)cc1.CC(NC(C)(C)C)c1ccc(C#CC#CCOCC(C)(C)C)cc1.CC(NC(C)(C)C)c1ccc(C#CCOCCCOCC(C)(C)C)cc1.CCCCCOc1ccc(C(C)(C)C)nc1.CCCOC1CCN(CCC(C)(C)C)CC1.CCCS(=O)(=O)c1ccc(OCC(C)(C)C)cc1.C[C@@H](CNC(C)(C)C)Oc1cc(C(C)(C)C)ccn1
InChIInChI=1S/C24H36N2O2.C23H39N3O2.C23H35N3O.C23H40N2O.C23H37NO2.C22H39N3O.C22H31NO.2C16H28N2O.C15H25NO.C14H29NO.2C14H23NO.C14H22O3S.3C4H10/c1-18(25-24(5,6)7)19-8-10-20(11-9-19)21-12-13-26(22(27)16-21)14-15-28-17-23(2,3)4;1-22(2,3)18-28-16-11-21(27)26-14-12-25(13-15-26)20-9-7-19(8-10-20)17-24-23(4,5)6;1-17(26-23(5,6)7)19-8-10-20(11-9-19)21-24-14-18(15-25-21)12-13-27-16-22(2,3)4;1-22(2,3)18-26-16-15-25-13-11-21(12-14-25)20-9-7-19(8-10-20)17-24-23(4,5)6;1-19(24-23(5,6)7)21-13-11-20(12-14-21)10-8-15-25-16-9-17-26-18-22(2,3)4;1-21(2,3)18-26-16-15-24-11-13-25(14-12-24)20-9-7-19(8-10-20)17-23-22(4,5)6;1-18(23-22(5,6)7)20-14-12-19(13-15-20)11-9-8-10-16-24-17-21(2,3)4;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;1-14(2,3)13-17-12-10-8-7-9-11-16-15(4,5)6;1-5-12-16-13-6-9-15(10-7-13)11-8-14(2,3)4;1-5-6-7-10-16-12-8-9-13(15-11-12)14(2,3)4;1-13(2,3)15-11-9-7-8-10-12-16-14(4,5)6;1-5-10-18(15,16)13-8-6-12(7-9-13)17-11-14(2,3)4;3*1-4(2)3/h8-13,16,18,25H,14-15,17H2,1-7H3;7-10,24H,11-18H2,1-6H3;8-11,14-15,17,26H,12-13,16H2,1-7H3;7-10,21,24H,11-18H2,1-6H3;11-14,19,24H,9,15-18H2,1-7H3;7-10,23H,11-18H2,1-6H3;12-15,18,23H,16-17H2,1-7H3;8-10,12,18H,11H2,1-7H3;8-9,12,18H,7,10-11H2,1-6H3;16H,11-13H2,1-6H3;13H,5-12H2,1-4H3;8-9,11H,5-7,10H2,1-4H3;15H,11-12H2,1-6H3;6-9H,5,10-11H2,1-4H3;3*4H,1-3H3/t;;;;;;;12-;;;;;;;;;/m.......0........./s1
InChIKeyHSAOQDZANGQZKI-CJHDTUIESA-N
MW4429.95 g/mol
LogP59.24
Rot. Bonds76

About 4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane)

4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane) (PubChem CID 158570647) has the molecular formula C275H465N23O19S and a molecular weight of 4429.95 g/mol. Its IUPAC name is 4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane).

Molecular Properties

Compound Name4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane)
PubChem CID158570647
Molecular FormulaC275H465N23O19S
Molecular Weight4429.95 g/mol
Exact Mass4426.58
IUPAC Name4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane)
SMILESCC(C)(C)COCC#CC#CCNC(C)(C)C.CC(C)(C)COCCC(=O)N1CCN(c2ccc(CNC(C)(C)C)cc2)CC1.CC(C)(C)COCCN1CCC(c2ccc(CNC(C)(C)C)cc2)CC1.CC(C)(C)COCCN1CCN(c2ccc(CNC(C)(C)C)cc2)CC1.CC(C)(C)NCC#CC#CCOC(C)(C)C.CC(C)(C)NCCCOc1ccc(C(C)(C)C)nc1.CC(C)C.CC(C)C.CC(C)C.CC(NC(C)(C)C)c1ccc(-c2ccn(CCOCC(C)(C)C)c(=O)c2)cc1.CC(NC(C)(C)C)c1ccc(-c2ncc(CCOCC(C)(C)C)cn2)cc1.CC(NC(C)(C)C)c1ccc(C#CC#CCOCC(C)(C)C)cc1.CC(NC(C)(C)C)c1ccc(C#CCOCCCOCC(C)(C)C)cc1.CCCCCOc1ccc(C(C)(C)C)nc1.CCCOC1CCN(CCC(C)(C)C)CC1.CCCS(=O)(=O)c1ccc(OCC(C)(C)C)cc1.C[C@@H](CNC(C)(C)C)Oc1cc(C(C)(C)C)ccn1
InChIInChI=1S/C24H36N2O2.C23H39N3O2.C23H35N3O.C23H40N2O.C23H37NO2.C22H39N3O.C22H31NO.2C16H28N2O.C15H25NO.C14H29NO.2C14H23NO.C14H22O3S.3C4H10/c1-18(25-24(5,6)7)19-8-10-20(11-9-19)21-12-13-26(22(27)16-21)14-15-28-17-23(2,3)4;1-22(2,3)18-28-16-11-21(27)26-14-12-25(13-15-26)20-9-7-19(8-10-20)17-24-23(4,5)6;1-17(26-23(5,6)7)19-8-10-20(11-9-19)21-24-14-18(15-25-21)12-13-27-16-22(2,3)4;1-22(2,3)18-26-16-15-25-13-11-21(12-14-25)20-9-7-19(8-10-20)17-24-23(4,5)6;1-19(24-23(5,6)7)21-13-11-20(12-14-21)10-8-15-25-16-9-17-26-18-22(2,3)4;1-21(2,3)18-26-16-15-24-11-13-25(14-12-24)20-9-7-19(8-10-20)17-23-22(4,5)6;1-18(23-22(5,6)7)20-14-12-19(13-15-20)11-9-8-10-16-24-17-21(2,3)4;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;1-14(2,3)13-17-12-10-8-7-9-11-16-15(4,5)6;1-5-12-16-13-6-9-15(10-7-13)11-8-14(2,3)4;1-5-6-7-10-16-12-8-9-13(15-11-12)14(2,3)4;1-13(2,3)15-11-9-7-8-10-12-16-14(4,5)6;1-5-10-18(15,16)13-8-6-12(7-9-13)17-11-14(2,3)4;3*1-4(2)3/h8-13,16,18,25H,14-15,17H2,1-7H3;7-10,24H,11-18H2,1-6H3;8-11,14-15,17,26H,12-13,16H2,1-7H3;7-10,21,24H,11-18H2,1-6H3;11-14,19,24H,9,15-18H2,1-7H3;7-10,23H,11-18H2,1-6H3;12-15,18,23H,16-17H2,1-7H3;8-10,12,18H,11H2,1-7H3;8-9,12,18H,7,10-11H2,1-6H3;16H,11-13H2,1-6H3;13H,5-12H2,1-4H3;8-9,11H,5-7,10H2,1-4H3;15H,11-12H2,1-6H3;6-9H,5,10-11H2,1-4H3;3*4H,1-3H3/t;;;;;;;12-;;;;;;;;;/m.......0........./s1
InChIKeyHSAOQDZANGQZKI-CJHDTUIESA-N
XLogP59.24
TPSA427.88 Ų
H-Bond Donors11
H-Bond Acceptors41
Rotatable Bonds76
Heavy Atoms318
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004429.95
LogP ≤ 559.24
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1041

Analyze 4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane) with MolForge

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Related Compounds

4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;2-tert-butyl-4-(6,6-dimethylheptan-2-yloxy)pyridine;2-tert-butyl-5-(6,6-dimethylheptoxy)pyridine;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;N-[3-[(6-tert-butyl-3-pyridinyl)oxy]propyl]-2-methylpropan-2-amine;N-[2-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]ethyl]-2-methylpropan-2-amine;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;N-[1-[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[2-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]ethyl]-2-methylpropan-2-amine;N-[(2R)-2-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]propyl]-2-methylpropan-2-amine
CID 167606436
4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;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);2-tert-butyl-5-(6,6-dimethylheptoxy)pyridine;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-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;N-[1-[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;ethane
CID 167629432
4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[1-[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;2-methylpropane
CID 159367141
4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-5-[4-[3-(2,2-dimethylpropoxy)propoxy]phenyl]pyrazin-2-amine;N-tert-butyl-6-[4-[3-(2,2-dimethylpropoxy)propoxy]phenyl]pyridin-3-amine;N-[1-[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;ethane
CID 163604477
4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;2-tert-butyl-4-(6,6-dimethylheptan-2-yloxy)pyridine;N-tert-butyl-5-[4-[3-(2,2-dimethylpropoxy)propoxy]phenyl]pyrazin-2-amine;N-tert-butyl-6-[4-[3-(2,2-dimethylpropoxy)propoxy]phenyl]pyridin-3-amine;N-[2-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]ethyl]-2-methylpropan-2-amine;N-[1-[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[2-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]ethyl]-2-methylpropan-2-amine;N-[(2R)-2-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]propyl]-2-methylpropan-2-amine;N-[(2S)-2-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]propyl]-2-methylpropan-2-amine;ethane
CID 161138242
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);bis(N-tert-butyl-3-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]cyclobutan-1-amine);2-tert-butyl-5-(6,6-dimethylheptoxy)pyridine;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;bis(N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine);N-tert-butyl-3-[4-(2,2-dimethylpropyl)phenoxy]cyclobutan-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-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-(4,4-dimethylpentoxy)-4-(2,2-dimethylpropoxy)benzene;1-(4,4-dimethylpentylsulfonyl)-4-(2,2-dimethylpropoxy)benzene;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;ethane
CID 157162926
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-4-(6,6-dimethylheptan-2-yloxy)pyridine;2-tert-butyl-5-(5,5-dimethylhexoxy)-1-benzofuran;N-[2-[(6-tert-butyl-2-pyridinyl)oxy]ethyl]-2-methylpropan-2-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-[2-[3-(3,3-dimethylbutyl)phenoxy]ethyl]-2-methylpropan-2-amine;N-[(2R)-2-[3-(3,3-dimethylbutyl)phenoxy]propyl]-2-methylpropan-2-amine;N-[(2S)-2-[3-(3,3-dimethylbutyl)phenoxy]propyl]-2-methylpropan-2-amine;N-[2-[[5-(3,3-dimethylbutyl)-2-pyridinyl]oxy]ethyl]-2-methylpropan-2-amine;N-[1-[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[2-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]ethyl]-2-methylpropan-2-amine;N-[(2R)-2-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]propyl]-2-methylpropan-2-amine;N-[(2S)-2-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]propyl]-2-methylpropan-2-amine;ethane
CID 167584742
[(3R)-3-(tert-butylamino)pyrrolidin-1-yl]-[2-(2,2-dimethylpropoxy)phenyl]methanone;1-[(3R)-3-(tert-butylamino)pyrrolidin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;1-tert-butyl-4-(3,3-dimethylbutyl)piperazine;N-tert-butyl-1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-amine;N-tert-butyl-4-[4-(2,2-dimethylpropyl)phenyl]butan-1-amine;1-(3,3-dimethylbutyl)-3-(4,4-dimethylpentoxy)benzene;N-[[4-[2-(2,2-dimethylpropoxy)ethyl]phenyl]methyl]-2-methylpropan-2-amine;bis(N-[1-[4-[(3S)-3-(2,2-dimethylpropoxy)pyrrolidin-1-yl]phenyl]ethyl]-2-methylpropan-2-amine);N-[2-[4-(2,2-dimethylpropyl)phenoxy]ethyl]-2-methylpropan-2-amine
CID 158858565
N-tert-butyl-1-(4-tert-butyl-2-pyridinyl)azetidin-3-amine;N-tert-butyl-1-(5-tert-butyl-2-pyridinyl)azetidin-3-amine;N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-1-[5-(2,2-dimethylpropoxy)-2-pyridinyl]azetidin-3-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;2-methylpropane;3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine
CID 167688932
N-tert-butyl-3-(5-tert-butylpyrazin-2-yl)oxycyclobutan-1-amine;N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;N-tert-butyl-1-(4-tert-butyl-2-pyridinyl)pyrrolidin-3-amine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;N-tert-butyl-3-[[5-(2,2-dimethylpropoxy)-2-pyridinyl]oxy]cyclobutan-1-amine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;1-(4-tert-butyl-2-pyridinyl)azetidin-3-amine;1-(5-tert-butyl-2-pyridinyl)azetidin-3-amine;N-[2-[3-[2-(2,2-dimethylpropoxy)ethoxy]cyclobutyl]oxyethyl]-2-methylpropan-2-amine;1-[5-(2,2-dimethylpropoxy)-2-pyridinyl]azetidin-3-amine;tetrakis(2-methylpropane);3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine
CID 159961127
[(3R)-3-(tert-butylamino)pyrrolidin-1-yl]-[2-(2,2-dimethylpropoxy)phenyl]methanone;bis(N-tert-butyl-3-[2-(2,2-dimethylpropoxy)ethoxy]cyclobutan-1-amine);1-tert-butyl-3-[3-(2,2-dimethylpropoxy)propoxy]azetidine;N-[2-[2-(3-tert-butylpyrazol-1-yl)ethoxy]ethyl]-2-methylpropan-2-amine;N-[2-[3-[(2R)-3,3-dimethylbutan-2-yl]oxypropoxy]ethyl]-2-methylpropan-2-amine;N-[2-[3-[(2S)-3,3-dimethylbutan-2-yl]oxypropoxy]ethyl]-2-methylpropan-2-amine;N-[2-[4-(3,3-dimethylbutyl)piperazin-1-yl]ethyl]-2-methylpropan-2-amine;N-[3-[4-(3,3-dimethylbutyl)piperazin-1-yl]propyl]-2-methylpropan-2-amine;N-[3-(5,5-dimethylhexoxy)propyl]-2-methylpropan-2-amine;N-[1-[4-[(3R)-3-(2,2-dimethylpropoxy)cyclopentyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[(3S)-3-(2,2-dimethylpropoxy)pyrrolidin-1-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[2-[4-(2,2-dimethylpropyl)phenoxy]ethyl]-2-methylpropan-2-amine;N-[3-[[3-(2,2-dimethylpropyl)phenyl]methoxy]propyl]-2-methylpropan-2-amine
CID 157185349
N-tert-butyl-3-[(2-tert-butyl-4-pyridinyl)oxy]cyclobutan-1-amine;1-tert-butyl-4-(4-tert-butyl-2-pyridinyl)piperazine;1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethyl]piperazine;1-tert-butyl-4-[4-(2,2-dimethylpropoxy)-2-pyridinyl]piperazine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-tert-butyl-3-[[5-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]oxy]cyclobutan-1-amine;1-(4-tert-butylpiperazin-1-yl)-6,6-dimethylheptan-1-one;(4-tert-butylpiperazin-1-yl)-[3-(2,2-dimethylpropyl)phenyl]methanone;2-methylpropane;3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclobutan-1-amine
CID 167706423

Frequently Asked Questions

What is the IUPAC name of 4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane)?
The IUPAC name of 4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane) (CID 158570647) is 4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane).
What is the SMILES notation for 4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane)?
The canonical SMILES for 4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane) is CC(C)(C)COCC#CC#CCNC(C)(C)C.CC(C)(C)COCCC(=O)N1CCN(c2ccc(CNC(C)(C)C)cc2)CC1.CC(C)(C)COCCN1CCC(c2ccc(CNC(C)(C)C)cc2)CC1.CC(C)(C)COCCN1CCN(c2ccc(CNC(C)(C)C)cc2)CC1.CC(C)(C)NCC#CC#CCOC(C)(C)C.CC(C)(C)NCCCOc1ccc(C(C)(C)C)nc1.CC(C)C.CC(C)C.CC(C)C.CC(NC(C)(C)C)c1ccc(-c2ccn(CCOCC(C)(C)C)c(=O)c2)cc1.CC(NC(C)(C)C)c1ccc(-c2ncc(CCOCC(C)(C)C)cn2)cc1.CC(NC(C)(C)C)c1ccc(C#CC#CCOCC(C)(C)C)cc1.CC(NC(C)(C)C)c1ccc(C#CCOCCCOCC(C)(C)C)cc1.CCCCCOc1ccc(C(C)(C)C)nc1.CCCOC1CCN(CCC(C)(C)C)CC1.CCCS(=O)(=O)c1ccc(OCC(C)(C)C)cc1.C[C@@H](CNC(C)(C)C)Oc1cc(C(C)(C)C)ccn1.
What is the InChIKey of 4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane)?
The InChIKey is HSAOQDZANGQZKI-CJHDTUIESA-N. The full InChI is InChI=1S/C24H36N2O2.C23H39N3O2.C23H35N3O.C23H40N2O.C23H37NO2.C22H39N3O.C22H31NO.2C16H28N2O.C15H25NO.C14H29NO.2C14H23NO.C14H22O3S.3C4H10/c1-18(25-24(5,6)7)19-8-10-20(11-9-19)21-12-13-26(22(27)16-21)14-15-28-17-23(2,3)4;1-22(2,3)18-28-16-11-21(27)26-14-12-25(13-15-26)20-9-7-19(8-10-20)17-24-23(4,5)6;1-17(26-23(5,6)7)19-8-10-20(11-9-19)21-24-14-18(15-25-21)12-13-27-16-22(2,3)4;1-22(2,3)18-26-16-15-25-13-11-21(12-14-25)20-9-7-19(8-10-20)17-24-23(4,5)6;1-19(24-23(5,6)7)21-13-11-20(12-14-21)10-8-15-25-16-9-17-26-18-22(2,3)4;1-21(2,3)18-26-16-15-24-11-13-25(14-12-24)20-9-7-19(8-10-20)17-23-22(4,5)6;1-18(23-22(5,6)7)20-14-12-19(13-15-20)11-9-8-10-16-24-17-21(2,3)4;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;1-14(2,3)13-17-12-10-8-7-9-11-16-15(4,5)6;1-5-12-16-13-6-9-15(10-7-13)11-8-14(2,3)4;1-5-6-7-10-16-12-8-9-13(15-11-12)14(2,3)4;1-13(2,3)15-11-9-7-8-10-12-16-14(4,5)6;1-5-10-18(15,16)13-8-6-12(7-9-13)17-11-14(2,3)4;3*1-4(2)3/h8-13,16,18,25H,14-15,17H2,1-7H3;7-10,24H,11-18H2,1-6H3;8-11,14-15,17,26H,12-13,16H2,1-7H3;7-10,21,24H,11-18H2,1-6H3;11-14,19,24H,9,15-18H2,1-7H3;7-10,23H,11-18H2,1-6H3;12-15,18,23H,16-17H2,1-7H3;8-10,12,18H,11H2,1-7H3;8-9,12,18H,7,10-11H2,1-6H3;16H,11-13H2,1-6H3;13H,5-12H2,1-4H3;8-9,11H,5-7,10H2,1-4H3;15H,11-12H2,1-6H3;6-9H,5,10-11H2,1-4H3;3*4H,1-3H3/t;;;;;;;12-;;;;;;;;;/m.......0........./s1.
What are the key properties of 4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane)?
4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane) has a molecular weight of 4429.95 g/mol, XLogP of 59.24, 76 rotatable bonds, 11 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[1-(tert-butylamino)ethyl]phenyl]-1-[2-(2,2-dimethylpropoxy)ethyl]pyridin-2-one;1-[4-[4-[(tert-butylamino)methyl]phenyl]piperazin-1-yl]-3-(2,2-dimethylpropoxy)propan-1-one;N-tert-butyl-6-(2,2-dimethylpropoxy)hexa-2,4-diyn-1-amine;N-tert-butyl-6-[(2-methylpropan-2-yl)oxy]hexa-2,4-diyn-1-amine;2-tert-butyl-5-pentoxypyridine;N-[(2S)-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-propoxypiperidine;N-[[4-[4-[2-(2,2-dimethylpropoxy)ethyl]piperazin-1-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[[4-[1-[2-(2,2-dimethylpropoxy)ethyl]piperidin-4-yl]phenyl]methyl]-2-methylpropan-2-amine;N-[1-[4-[5-[2-(2,2-dimethylpropoxy)ethyl]pyrimidin-2-yl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[5-(2,2-dimethylpropoxy)penta-1,3-diynyl]phenyl]ethyl]-2-methylpropan-2-amine;N-[1-[4-[3-[3-(2,2-dimethylpropoxy)propoxy]prop-1-ynyl]phenyl]ethyl]-2-methylpropan-2-amine;1-(2,2-dimethylpropoxy)-4-propylsulfonylbenzene;tris(2-methylpropane) is sourced from PubChem (CID 158570647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).