1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine

C221H446N32O14 — CID 161485584

IUPAC1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine
SMILESCC(C)(C)OC1CCN(CC2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)OC1CN(CCCN2CCN(C(C)(C)C)CC2)C1.CC(C)(C)OCCCN1CC2(C1)CN(C(C)(C)C)C2.CC(C)(C)OCCCN1CCC2(CC1)CN(C(C)(C)C)C2.CC(C)(C)OCCCN1CCOC2(CCN(C(C)(C)C)CC2)C1.CC(C)(C)OCCN1CC(CCN2CCN(C(C)(C)C)CC2)C1.CC(C)(C)OCCN1CC(CN2CCNCC2)C1.CC(C)(C)OCCN1CCC(N2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)OCCN1CCN(CC2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)OCCN1CCN(CC2CN(C(C)(C)C)C2)CC1.CC(C)(C)OCCN1CC[C@@H](CN2CCN(C(C)(C)C)CC2)C1.CC(C)(C)OCCN1CC[C@H](Oc2cnc(C(C)(C)C)cn2)C1.CC(C)C
InChIInChI=1S/C20H41N3O.3C19H39N3O.C19H38N2O2.C19H38N2O.C18H31N3O2.2C18H37N3O.C18H36N2O.C16H32N2O.C14H29N3O.C4H10/c1-19(2,3)23-9-7-18(8-10-23)17-22-13-11-21(12-14-22)15-16-24-20(4,5)6;1-18(2,3)22-13-11-21(12-14-22)17-7-9-20(10-8-17)15-16-23-19(4,5)6;1-18(2,3)22-11-9-21(10-12-22)16-17-7-8-20(15-17)13-14-23-19(4,5)6;1-18(2,3)22-11-9-20(10-12-22)8-7-17-15-21(16-17)13-14-23-19(4,5)6;1-17(2,3)21-11-8-19(9-12-21)16-20(13-15-23-19)10-7-14-22-18(4,5)6;1-18(2,3)21-13-7-16(8-14-21)15-20-11-9-17(10-12-20)22-19(4,5)6;1-17(2,3)15-11-20-16(12-19-15)23-14-7-8-21(13-14)9-10-22-18(4,5)6;1-17(2,3)21-14-16(15-21)13-20-9-7-19(8-10-20)11-12-22-18(4,5)6;1-17(2,3)21-12-10-19(11-13-21)8-7-9-20-14-16(15-20)22-18(4,5)6;1-16(2,3)20-14-18(15-20)8-11-19(12-9-18)10-7-13-21-17(4,5)6;1-14(2,3)18-12-16(13-18)10-17(11-16)8-7-9-19-15(4,5)6;1-14(2,3)18-9-8-17-11-13(12-17)10-16-6-4-15-5-7-16;1-4(2)3/h18H,7-17H2,1-6H3;3*17H,7-16H2,1-6H3;7-16H2,1-6H3;16-17H,7-15H2,1-6H3;11-12,14H,7-10,13H2,1-6H3;2*16H,7-15H2,1-6H3;7-15H2,1-6H3;7-13H2,1-6H3;13,15H,4-12H2,1-3H3;4H,1-3H3/t;;17-;;;;14-;;;;;;/m..1...0....../s1
InChIKeyWEXWTHUUOUEYBH-UJNAXQJSSA-N
MW3776.21 g/mol
LogP33.40
Rot. Bonds55

About 1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine

1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine (PubChem CID 161485584) has the molecular formula C221H446N32O14 and a molecular weight of 3776.21 g/mol. Its IUPAC name is 1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine.

Molecular Properties

Compound Name1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine
PubChem CID161485584
Molecular FormulaC221H446N32O14
Molecular Weight3776.21 g/mol
Exact Mass3773.52
IUPAC Name1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine
SMILESCC(C)(C)OC1CCN(CC2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)OC1CN(CCCN2CCN(C(C)(C)C)CC2)C1.CC(C)(C)OCCCN1CC2(C1)CN(C(C)(C)C)C2.CC(C)(C)OCCCN1CCC2(CC1)CN(C(C)(C)C)C2.CC(C)(C)OCCCN1CCOC2(CCN(C(C)(C)C)CC2)C1.CC(C)(C)OCCN1CC(CCN2CCN(C(C)(C)C)CC2)C1.CC(C)(C)OCCN1CC(CN2CCNCC2)C1.CC(C)(C)OCCN1CCC(N2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)OCCN1CCN(CC2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)OCCN1CCN(CC2CN(C(C)(C)C)C2)CC1.CC(C)(C)OCCN1CC[C@@H](CN2CCN(C(C)(C)C)CC2)C1.CC(C)(C)OCCN1CC[C@H](Oc2cnc(C(C)(C)C)cn2)C1.CC(C)C
InChIInChI=1S/C20H41N3O.3C19H39N3O.C19H38N2O2.C19H38N2O.C18H31N3O2.2C18H37N3O.C18H36N2O.C16H32N2O.C14H29N3O.C4H10/c1-19(2,3)23-9-7-18(8-10-23)17-22-13-11-21(12-14-22)15-16-24-20(4,5)6;1-18(2,3)22-13-11-21(12-14-22)17-7-9-20(10-8-17)15-16-23-19(4,5)6;1-18(2,3)22-11-9-21(10-12-22)16-17-7-8-20(15-17)13-14-23-19(4,5)6;1-18(2,3)22-11-9-20(10-12-22)8-7-17-15-21(16-17)13-14-23-19(4,5)6;1-17(2,3)21-11-8-19(9-12-21)16-20(13-15-23-19)10-7-14-22-18(4,5)6;1-18(2,3)21-13-7-16(8-14-21)15-20-11-9-17(10-12-20)22-19(4,5)6;1-17(2,3)15-11-20-16(12-19-15)23-14-7-8-21(13-14)9-10-22-18(4,5)6;1-17(2,3)21-14-16(15-21)13-20-9-7-19(8-10-20)11-12-22-18(4,5)6;1-17(2,3)21-12-10-19(11-13-21)8-7-9-20-14-16(15-20)22-18(4,5)6;1-16(2,3)20-14-18(15-20)8-11-19(12-9-18)10-7-13-21-17(4,5)6;1-14(2,3)18-12-16(13-18)10-17(11-16)8-7-9-19-15(4,5)6;1-14(2,3)18-9-8-17-11-13(12-17)10-16-6-4-15-5-7-16;1-4(2)3/h18H,7-17H2,1-6H3;3*17H,7-16H2,1-6H3;7-16H2,1-6H3;16-17H,7-15H2,1-6H3;11-12,14H,7-10,13H2,1-6H3;2*16H,7-15H2,1-6H3;7-15H2,1-6H3;7-13H2,1-6H3;13,15H,4-12H2,1-3H3;4H,1-3H3/t;;17-;;;;14-;;;;;;/m..1...0....../s1
InChIKeyWEXWTHUUOUEYBH-UJNAXQJSSA-N
XLogP33.40
TPSA260.99 Ų
H-Bond Donors1
H-Bond Acceptors46
Rotatable Bonds55
Heavy Atoms267
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003776.21
LogP ≤ 533.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1046

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine?
The IUPAC name of 1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine (CID 161485584) is 1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine.
What is the SMILES notation for 1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine?
The canonical SMILES for 1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine is CC(C)(C)OC1CCN(CC2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)OC1CN(CCCN2CCN(C(C)(C)C)CC2)C1.CC(C)(C)OCCCN1CC2(C1)CN(C(C)(C)C)C2.CC(C)(C)OCCCN1CCC2(CC1)CN(C(C)(C)C)C2.CC(C)(C)OCCCN1CCOC2(CCN(C(C)(C)C)CC2)C1.CC(C)(C)OCCN1CC(CCN2CCN(C(C)(C)C)CC2)C1.CC(C)(C)OCCN1CC(CN2CCNCC2)C1.CC(C)(C)OCCN1CCC(N2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)OCCN1CCN(CC2CCN(C(C)(C)C)CC2)CC1.CC(C)(C)OCCN1CCN(CC2CN(C(C)(C)C)C2)CC1.CC(C)(C)OCCN1CC[C@@H](CN2CCN(C(C)(C)C)CC2)C1.CC(C)(C)OCCN1CC[C@H](Oc2cnc(C(C)(C)C)cn2)C1.CC(C)C.
What is the InChIKey of 1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine?
The InChIKey is WEXWTHUUOUEYBH-UJNAXQJSSA-N. The full InChI is InChI=1S/C20H41N3O.3C19H39N3O.C19H38N2O2.C19H38N2O.C18H31N3O2.2C18H37N3O.C18H36N2O.C16H32N2O.C14H29N3O.C4H10/c1-19(2,3)23-9-7-18(8-10-23)17-22-13-11-21(12-14-22)15-16-24-20(4,5)6;1-18(2,3)22-13-11-21(12-14-22)17-7-9-20(10-8-17)15-16-23-19(4,5)6;1-18(2,3)22-11-9-21(10-12-22)16-17-7-8-20(15-17)13-14-23-19(4,5)6;1-18(2,3)22-11-9-20(10-12-22)8-7-17-15-21(16-17)13-14-23-19(4,5)6;1-17(2,3)21-11-8-19(9-12-21)16-20(13-15-23-19)10-7-14-22-18(4,5)6;1-18(2,3)21-13-7-16(8-14-21)15-20-11-9-17(10-12-20)22-19(4,5)6;1-17(2,3)15-11-20-16(12-19-15)23-14-7-8-21(13-14)9-10-22-18(4,5)6;1-17(2,3)21-14-16(15-21)13-20-9-7-19(8-10-20)11-12-22-18(4,5)6;1-17(2,3)21-12-10-19(11-13-21)8-7-9-20-14-16(15-20)22-18(4,5)6;1-16(2,3)20-14-18(15-20)8-11-19(12-9-18)10-7-13-21-17(4,5)6;1-14(2,3)18-12-16(13-18)10-17(11-16)8-7-9-19-15(4,5)6;1-14(2,3)18-9-8-17-11-13(12-17)10-16-6-4-15-5-7-16;1-4(2)3/h18H,7-17H2,1-6H3;3*17H,7-16H2,1-6H3;7-16H2,1-6H3;16-17H,7-15H2,1-6H3;11-12,14H,7-10,13H2,1-6H3;2*16H,7-15H2,1-6H3;7-15H2,1-6H3;7-13H2,1-6H3;13,15H,4-12H2,1-3H3;4H,1-3H3/t;;17-;;;;14-;;;;;;/m..1...0....../s1.
What are the key properties of 1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine?
1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine has a molecular weight of 3776.21 g/mol, XLogP of 33.40, 55 rotatable bonds, 1 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-tert-butylazetidin-3-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]azetidin-1-yl]propyl]piperazine;1-tert-butyl-4-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]ethyl]piperazine;1-tert-butyl-4-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]piperazine;1-tert-butyl-4-[[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]methyl]piperazine;2-tert-butyl-5-[(3S)-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-yl]oxypyrazine;1-tert-butyl-4-[[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]methyl]piperidine;2-tert-butyl-6-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,6-diazaspiro[3.3]heptane;2-tert-butyl-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2,7-diazaspiro[3.5]nonane;9-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]-1-oxa-4,9-diazaspiro[5.5]undecane;1-[(1-tert-butylpiperidin-4-yl)methyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-methylpropane;1-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]azetidin-3-yl]methyl]piperazine is sourced from PubChem (CID 161485584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).