1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole

C212H414N12O62 — CID 157360875

IUPAC1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole
SMILESCCCOC.CCOC.COCCCCCCOC.COCCCCCOCCCOC.COCCCCOC.COCCCCOCCOC.COCCCOC.COCCCOCCCOC.COCCCOCCOC.COCCCOCCOCCOC.COCCOC.COCCOCCCOCCOC.COCCOCCOC.COCCOCCOCCOC.COCCOCCOCCOCCOC.COCCOCCOCCOCCOCCOC.COCCOCCOCCOCCOCCOCCOC.Cc1ccc(N2CCN(CCCCCCc3cc(C)on3)CC2)cc1.Cc1ccc(N2CCN(CCCCOCc3cc(C)on3)CC2)cc1.Cc1ccc(N2CCN(CCCOCCc3cc(C)on3)CC2)cc1.Cc1ccc(N2CCN(CCOCCCc3cc(C)on3)CC2)cc1
InChIInChI=1S/C21H31N3O.3C20H29N3O2.C14H30O7.C12H26O6.C10H22O5.C10H22O3.2C9H20O4.C8H18O4.2C8H18O3.C8H18O2.C7H16O3.C6H14O3.C6H14O2.C5H12O2.C4H10O2.C4H10O.C3H8O/c1-18-8-10-21(11-9-18)24-15-13-23(14-16-24)12-6-4-3-5-7-20-17-19(2)25-22-20;1-17-4-6-20(7-5-17)23-12-10-22(11-13-23)9-3-14-24-15-8-19-16-18(2)25-21-19;1-17-5-7-20(8-6-17)23-11-9-22(10-12-23)13-15-24-14-3-4-19-16-18(2)25-21-19;1-17-5-7-20(8-6-17)23-12-10-22(11-13-23)9-3-4-14-24-16-19-15-18(2)25-21-19;1-15-3-5-17-7-9-19-11-13-21-14-12-20-10-8-18-6-4-16-2;1-13-3-5-15-7-9-17-11-12-18-10-8-16-6-4-14-2;1-11-3-5-13-7-9-15-10-8-14-6-4-12-2;1-11-7-4-3-5-9-13-10-6-8-12-2;1-10-6-8-12-4-3-5-13-9-7-11-2;1-10-4-3-5-12-8-9-13-7-6-11-2;1-9-3-5-11-7-8-12-6-4-10-2;1-9-5-3-7-11-8-4-6-10-2;1-9-5-3-4-6-11-8-7-10-2;1-9-7-5-3-4-6-8-10-2;1-8-4-3-5-10-7-6-9-2;1-7-3-5-9-6-4-8-2;1-7-5-3-4-6-8-2;1-6-4-3-5-7-2;1-5-3-4-6-2;1-3-4-5-2;1-3-4-2/h8-11,17H,3-7,12-16H2,1-2H3;4-7,16H,3,8-15H2,1-2H3;5-8,16H,3-4,9-15H2,1-2H3;5-8,15H,3-4,9-14,16H2,1-2H3;3-14H2,1-2H3;3-12H2,1-2H3;3-10H2,1-2H3;3-10H2,1-2H3;2*3-9H2,1-2H3;3-8H2,1-2H3;2*3-8H2,1-2H3;3-8H2,1-2H3;3-7H2,1-2H3;3-6H2,1-2H3;3-6H2,1-2H3;3-5H2,1-2H3;3-4H2,1-2H3;3-4H2,1-2H3;3H2,1-2H3
InChIKeyBIPXJMLAKBDMJG-UHFFFAOYSA-N
MW4123.67 g/mol
LogP27.04
Rot. Bonds167

About 1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole

1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole (PubChem CID 157360875) has the molecular formula C212H414N12O62 and a molecular weight of 4123.67 g/mol. Its IUPAC name is 1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole.

Molecular Properties

Compound Name1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole
PubChem CID157360875
Molecular FormulaC212H414N12O62
Molecular Weight4123.67 g/mol
Exact Mass4120.96
IUPAC Name1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole
SMILESCCCOC.CCOC.COCCCCCCOC.COCCCCCOCCCOC.COCCCCOC.COCCCCOCCOC.COCCCOC.COCCCOCCCOC.COCCCOCCOC.COCCCOCCOCCOC.COCCOC.COCCOCCCOCCOC.COCCOCCOC.COCCOCCOCCOC.COCCOCCOCCOCCOC.COCCOCCOCCOCCOCCOC.COCCOCCOCCOCCOCCOCCOC.Cc1ccc(N2CCN(CCCCCCc3cc(C)on3)CC2)cc1.Cc1ccc(N2CCN(CCCCOCc3cc(C)on3)CC2)cc1.Cc1ccc(N2CCN(CCCOCCc3cc(C)on3)CC2)cc1.Cc1ccc(N2CCN(CCOCCCc3cc(C)on3)CC2)cc1
InChIInChI=1S/C21H31N3O.3C20H29N3O2.C14H30O7.C12H26O6.C10H22O5.C10H22O3.2C9H20O4.C8H18O4.2C8H18O3.C8H18O2.C7H16O3.C6H14O3.C6H14O2.C5H12O2.C4H10O2.C4H10O.C3H8O/c1-18-8-10-21(11-9-18)24-15-13-23(14-16-24)12-6-4-3-5-7-20-17-19(2)25-22-20;1-17-4-6-20(7-5-17)23-12-10-22(11-13-23)9-3-14-24-15-8-19-16-18(2)25-21-19;1-17-5-7-20(8-6-17)23-11-9-22(10-12-23)13-15-24-14-3-4-19-16-18(2)25-21-19;1-17-5-7-20(8-6-17)23-12-10-22(11-13-23)9-3-4-14-24-16-19-15-18(2)25-21-19;1-15-3-5-17-7-9-19-11-13-21-14-12-20-10-8-18-6-4-16-2;1-13-3-5-15-7-9-17-11-12-18-10-8-16-6-4-14-2;1-11-3-5-13-7-9-15-10-8-14-6-4-12-2;1-11-7-4-3-5-9-13-10-6-8-12-2;1-10-6-8-12-4-3-5-13-9-7-11-2;1-10-4-3-5-12-8-9-13-7-6-11-2;1-9-3-5-11-7-8-12-6-4-10-2;1-9-5-3-7-11-8-4-6-10-2;1-9-5-3-4-6-11-8-7-10-2;1-9-7-5-3-4-6-8-10-2;1-8-4-3-5-10-7-6-9-2;1-7-3-5-9-6-4-8-2;1-7-5-3-4-6-8-2;1-6-4-3-5-7-2;1-5-3-4-6-2;1-3-4-5-2;1-3-4-2/h8-11,17H,3-7,12-16H2,1-2H3;4-7,16H,3,8-15H2,1-2H3;5-8,16H,3-4,9-15H2,1-2H3;5-8,15H,3-4,9-14,16H2,1-2H3;3-14H2,1-2H3;3-12H2,1-2H3;3-10H2,1-2H3;3-10H2,1-2H3;2*3-9H2,1-2H3;3-8H2,1-2H3;2*3-8H2,1-2H3;3-8H2,1-2H3;3-7H2,1-2H3;3-6H2,1-2H3;3-6H2,1-2H3;3-5H2,1-2H3;3-4H2,1-2H3;3-4H2,1-2H3;3H2,1-2H3
InChIKeyBIPXJMLAKBDMJG-UHFFFAOYSA-N
XLogP27.04
TPSA665.38 Ų
H-Bond Donors
H-Bond Acceptors74
Rotatable Bonds167
Heavy Atoms286
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004123.67
LogP ≤ 527.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1074

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole?
The IUPAC name of 1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole (CID 157360875) is 1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole.
What is the SMILES notation for 1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole?
The canonical SMILES for 1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole is CCCOC.CCOC.COCCCCCCOC.COCCCCCOCCCOC.COCCCCOC.COCCCCOCCOC.COCCCOC.COCCCOCCCOC.COCCCOCCOC.COCCCOCCOCCOC.COCCOC.COCCOCCCOCCOC.COCCOCCOC.COCCOCCOCCOC.COCCOCCOCCOCCOC.COCCOCCOCCOCCOCCOC.COCCOCCOCCOCCOCCOCCOC.Cc1ccc(N2CCN(CCCCCCc3cc(C)on3)CC2)cc1.Cc1ccc(N2CCN(CCCCOCc3cc(C)on3)CC2)cc1.Cc1ccc(N2CCN(CCCOCCc3cc(C)on3)CC2)cc1.Cc1ccc(N2CCN(CCOCCCc3cc(C)on3)CC2)cc1.
What is the InChIKey of 1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole?
The InChIKey is BIPXJMLAKBDMJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H31N3O.3C20H29N3O2.C14H30O7.C12H26O6.C10H22O5.C10H22O3.2C9H20O4.C8H18O4.2C8H18O3.C8H18O2.C7H16O3.C6H14O3.C6H14O2.C5H12O2.C4H10O2.C4H10O.C3H8O/c1-18-8-10-21(11-9-18)24-15-13-23(14-16-24)12-6-4-3-5-7-20-17-19(2)25-22-20;1-17-4-6-20(7-5-17)23-12-10-22(11-13-23)9-3-14-24-15-8-19-16-18(2)25-21-19;1-17-5-7-20(8-6-17)23-11-9-22(10-12-23)13-15-24-14-3-4-19-16-18(2)25-21-19;1-17-5-7-20(8-6-17)23-12-10-22(11-13-23)9-3-4-14-24-16-19-15-18(2)25-21-19;1-15-3-5-17-7-9-19-11-13-21-14-12-20-10-8-18-6-4-16-2;1-13-3-5-15-7-9-17-11-12-18-10-8-16-6-4-14-2;1-11-3-5-13-7-9-15-10-8-14-6-4-12-2;1-11-7-4-3-5-9-13-10-6-8-12-2;1-10-6-8-12-4-3-5-13-9-7-11-2;1-10-4-3-5-12-8-9-13-7-6-11-2;1-9-3-5-11-7-8-12-6-4-10-2;1-9-5-3-7-11-8-4-6-10-2;1-9-5-3-4-6-11-8-7-10-2;1-9-7-5-3-4-6-8-10-2;1-8-4-3-5-10-7-6-9-2;1-7-3-5-9-6-4-8-2;1-7-5-3-4-6-8-2;1-6-4-3-5-7-2;1-5-3-4-6-2;1-3-4-5-2;1-3-4-2/h8-11,17H,3-7,12-16H2,1-2H3;4-7,16H,3,8-15H2,1-2H3;5-8,16H,3-4,9-15H2,1-2H3;5-8,15H,3-4,9-14,16H2,1-2H3;3-14H2,1-2H3;3-12H2,1-2H3;3-10H2,1-2H3;3-10H2,1-2H3;2*3-9H2,1-2H3;3-8H2,1-2H3;2*3-8H2,1-2H3;3-8H2,1-2H3;3-7H2,1-2H3;3-6H2,1-2H3;3-6H2,1-2H3;3-5H2,1-2H3;3-4H2,1-2H3;3-4H2,1-2H3;3H2,1-2H3.
What are the key properties of 1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole?
1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole has a molecular weight of 4123.67 g/mol, XLogP of 27.04, 167 rotatable bonds, 0 hydrogen bond donors, and 74 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(2-methoxyethoxy)propane;1,4-dimethoxybutane;1,2-dimethoxyethane;1,6-dimethoxyhexane;1,3-dimethoxypropane;methoxyethane;1-methoxy-4-(2-methoxyethoxy)butane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethane;1-methoxy-2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane;1-methoxy-3-[2-(2-methoxyethoxy)ethoxy]propane;1-methoxy-3-(2-methoxyethoxy)propane;1-methoxy-5-(3-methoxypropoxy)pentane;1-methoxy-3-(3-methoxypropoxy)propane;1-methoxypropane;5-methyl-3-[4-[4-(4-methylphenyl)piperazin-1-yl]butoxymethyl]-1,2-oxazole;5-methyl-3-[3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethoxy]propyl]-1,2-oxazole;5-methyl-3-[6-[4-(4-methylphenyl)piperazin-1-yl]hexyl]-1,2-oxazole;5-methyl-3-[2-[3-[4-(4-methylphenyl)piperazin-1-yl]propoxy]ethyl]-1,2-oxazole is sourced from PubChem (CID 157360875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).