4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane

C223H473N23O34 — CID 158306676

IUPAC4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane
SMILESCC(C)(C)C.CC(C)(C)CN1CCN(CNC(C)(C)C)CC1.CC(C)(C)CN1CCN(CNC(C)(C)C)CC1.CC(C)(C)CN1CCN(COC(C)(C)C)CC1.CC(C)(C)CN1CCN(COC(C)(C)C)CC1.CC(C)(C)CN1C[C@@H]2C[C@H]1CN2CNC(C)(C)C.CC(C)(C)CN1C[C@@H]2C[C@H]1CN2COC(C)(C)C.CC(C)(C)N1CCC2(CC1)CNCCO2.CC(C)(C)NC(=O)COCCOCCOC(C)(C)C.CC(C)(C)NCCOCCOCCOC(C)(C)C.CC(C)(C)NCCOCCOCCOCCOC(C)(C)C.CC(C)(C)OCCOCCOC(C)(C)C.CC(C)(C)OCCOCCOCCOC(C)(C)C.CC(C)OCCOCCOCCOCCOC(C)(C)C.CC(C)OCCOCCOCCOCCOCC(=O)NC(C)(C)C.CC(N1CCC2(CC1)CN(C(C)(C)C)CCO2)C(C)(C)C
InChIInChI=1S/C18H36N2O.C17H35NO6.C16H35NO4.C15H31N3.C15H30N2O.C15H32O5.2C14H31N3.2C14H30N2O.C14H29NO4.C14H31NO3.C14H30O4.C12H24N2O.C12H26O3.C5H12/c1-15(16(2,3)4)19-10-8-18(9-11-19)14-20(12-13-21-18)17(5,6)7;1-15(2)24-13-12-22-9-8-20-6-7-21-10-11-23-14-16(19)18-17(3,4)5;1-15(2,3)17-7-8-18-9-10-19-11-12-20-13-14-21-16(4,5)6;1-14(2,3)10-17-8-13-7-12(17)9-18(13)11-16-15(4,5)6;1-14(2,3)10-16-8-13-7-12(16)9-17(13)11-18-15(4,5)6;1-14(2)19-12-10-17-8-6-16-7-9-18-11-13-20-15(3,4)5;2*1-13(2,3)11-16-7-9-17(10-8-16)12-15-14(4,5)6;2*1-13(2,3)11-15-7-9-16(10-8-15)12-17-14(4,5)6;1-13(2,3)15-12(16)11-18-8-7-17-9-10-19-14(4,5)6;1-13(2,3)15-7-8-16-9-10-17-11-12-18-14(4,5)6;1-13(2,3)17-11-9-15-7-8-16-10-12-18-14(4,5)6;1-11(2,3)14-7-4-12(5-8-14)10-13-6-9-15-12;1-11(2,3)14-9-7-13-8-10-15-12(4,5)6;1-5(2,3)4/h15H,8-14H2,1-7H3;15H,6-14H2,1-5H3,(H,18,19);17H,7-14H2,1-6H3;12-13,16H,7-11H2,1-6H3;12-13H,7-11H2,1-6H3;14H,6-13H2,1-5H3;2*15H,7-12H2,1-6H3;2*7-12H2,1-6H3;7-11H2,1-6H3,(H,15,16);15H,7-12H2,1-6H3;7-12H2,1-6H3;13H,4-10H2,1-3H3;7-10H2,1-6H3;1-4H3/t;;;2*12-,13-;;;;;;;;;;;/m...00.........../s1
InChIKeyGNDWZRJESSESGX-BQDVQLIVSA-N
MW4021.36 g/mol
LogP35.38
Rot. Bonds91

About 4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane

4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane (PubChem CID 158306676) has the molecular formula C223H473N23O34 and a molecular weight of 4021.36 g/mol. Its IUPAC name is 4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane.

Molecular Properties

Compound Name4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane
PubChem CID158306676
Molecular FormulaC223H473N23O34
Molecular Weight4021.36 g/mol
Exact Mass4018.60
IUPAC Name4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane
SMILESCC(C)(C)C.CC(C)(C)CN1CCN(CNC(C)(C)C)CC1.CC(C)(C)CN1CCN(CNC(C)(C)C)CC1.CC(C)(C)CN1CCN(COC(C)(C)C)CC1.CC(C)(C)CN1CCN(COC(C)(C)C)CC1.CC(C)(C)CN1C[C@@H]2C[C@H]1CN2CNC(C)(C)C.CC(C)(C)CN1C[C@@H]2C[C@H]1CN2COC(C)(C)C.CC(C)(C)N1CCC2(CC1)CNCCO2.CC(C)(C)NC(=O)COCCOCCOC(C)(C)C.CC(C)(C)NCCOCCOCCOC(C)(C)C.CC(C)(C)NCCOCCOCCOCCOC(C)(C)C.CC(C)(C)OCCOCCOC(C)(C)C.CC(C)(C)OCCOCCOCCOC(C)(C)C.CC(C)OCCOCCOCCOCCOC(C)(C)C.CC(C)OCCOCCOCCOCCOCC(=O)NC(C)(C)C.CC(N1CCC2(CC1)CN(C(C)(C)C)CCO2)C(C)(C)C
InChIInChI=1S/C18H36N2O.C17H35NO6.C16H35NO4.C15H31N3.C15H30N2O.C15H32O5.2C14H31N3.2C14H30N2O.C14H29NO4.C14H31NO3.C14H30O4.C12H24N2O.C12H26O3.C5H12/c1-15(16(2,3)4)19-10-8-18(9-11-19)14-20(12-13-21-18)17(5,6)7;1-15(2)24-13-12-22-9-8-20-6-7-21-10-11-23-14-16(19)18-17(3,4)5;1-15(2,3)17-7-8-18-9-10-19-11-12-20-13-14-21-16(4,5)6;1-14(2,3)10-17-8-13-7-12(17)9-18(13)11-16-15(4,5)6;1-14(2,3)10-16-8-13-7-12(16)9-17(13)11-18-15(4,5)6;1-14(2)19-12-10-17-8-6-16-7-9-18-11-13-20-15(3,4)5;2*1-13(2,3)11-16-7-9-17(10-8-16)12-15-14(4,5)6;2*1-13(2,3)11-15-7-9-16(10-8-15)12-17-14(4,5)6;1-13(2,3)15-12(16)11-18-8-7-17-9-10-19-14(4,5)6;1-13(2,3)15-7-8-16-9-10-17-11-12-18-14(4,5)6;1-13(2,3)17-11-9-15-7-8-16-10-12-18-14(4,5)6;1-11(2,3)14-7-4-12(5-8-14)10-13-6-9-15-12;1-11(2,3)14-9-7-13-8-10-15-12(4,5)6;1-5(2,3)4/h15H,8-14H2,1-7H3;15H,6-14H2,1-5H3,(H,18,19);17H,7-14H2,1-6H3;12-13,16H,7-11H2,1-6H3;12-13H,7-11H2,1-6H3;14H,6-13H2,1-5H3;2*15H,7-12H2,1-6H3;2*7-12H2,1-6H3;7-11H2,1-6H3,(H,15,16);15H,7-12H2,1-6H3;7-12H2,1-6H3;13H,4-10H2,1-3H3;7-10H2,1-6H3;1-4H3/t;;;2*12-,13-;;;;;;;;;;;/m...00.........../s1
InChIKeyGNDWZRJESSESGX-BQDVQLIVSA-N
XLogP35.38
TPSA474.34 Ų
H-Bond Donors8
H-Bond Acceptors55
Rotatable Bonds91
Heavy Atoms280
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004021.36
LogP ≤ 535.38
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1055

Computed Properties (RDKit)

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

Analyze 4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane?
The IUPAC name of 4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane (CID 158306676) is 4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane.
What is the SMILES notation for 4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane?
The canonical SMILES for 4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane is CC(C)(C)C.CC(C)(C)CN1CCN(CNC(C)(C)C)CC1.CC(C)(C)CN1CCN(CNC(C)(C)C)CC1.CC(C)(C)CN1CCN(COC(C)(C)C)CC1.CC(C)(C)CN1CCN(COC(C)(C)C)CC1.CC(C)(C)CN1C[C@@H]2C[C@H]1CN2CNC(C)(C)C.CC(C)(C)CN1C[C@@H]2C[C@H]1CN2COC(C)(C)C.CC(C)(C)N1CCC2(CC1)CNCCO2.CC(C)(C)NC(=O)COCCOCCOC(C)(C)C.CC(C)(C)NCCOCCOCCOC(C)(C)C.CC(C)(C)NCCOCCOCCOCCOC(C)(C)C.CC(C)(C)OCCOCCOC(C)(C)C.CC(C)(C)OCCOCCOCCOC(C)(C)C.CC(C)OCCOCCOCCOCCOC(C)(C)C.CC(C)OCCOCCOCCOCCOCC(=O)NC(C)(C)C.CC(N1CCC2(CC1)CN(C(C)(C)C)CCO2)C(C)(C)C.
What is the InChIKey of 4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane?
The InChIKey is GNDWZRJESSESGX-BQDVQLIVSA-N. The full InChI is InChI=1S/C18H36N2O.C17H35NO6.C16H35NO4.C15H31N3.C15H30N2O.C15H32O5.2C14H31N3.2C14H30N2O.C14H29NO4.C14H31NO3.C14H30O4.C12H24N2O.C12H26O3.C5H12/c1-15(16(2,3)4)19-10-8-18(9-11-19)14-20(12-13-21-18)17(5,6)7;1-15(2)24-13-12-22-9-8-20-6-7-21-10-11-23-14-16(19)18-17(3,4)5;1-15(2,3)17-7-8-18-9-10-19-11-12-20-13-14-21-16(4,5)6;1-14(2,3)10-17-8-13-7-12(17)9-18(13)11-16-15(4,5)6;1-14(2,3)10-16-8-13-7-12(16)9-17(13)11-18-15(4,5)6;1-14(2)19-12-10-17-8-6-16-7-9-18-11-13-20-15(3,4)5;2*1-13(2,3)11-16-7-9-17(10-8-16)12-15-14(4,5)6;2*1-13(2,3)11-15-7-9-16(10-8-15)12-17-14(4,5)6;1-13(2,3)15-12(16)11-18-8-7-17-9-10-19-14(4,5)6;1-13(2,3)15-7-8-16-9-10-17-11-12-18-14(4,5)6;1-13(2,3)17-11-9-15-7-8-16-10-12-18-14(4,5)6;1-11(2,3)14-7-4-12(5-8-14)10-13-6-9-15-12;1-11(2,3)14-9-7-13-8-10-15-12(4,5)6;1-5(2,3)4/h15H,8-14H2,1-7H3;15H,6-14H2,1-5H3,(H,18,19);17H,7-14H2,1-6H3;12-13,16H,7-11H2,1-6H3;12-13H,7-11H2,1-6H3;14H,6-13H2,1-5H3;2*15H,7-12H2,1-6H3;2*7-12H2,1-6H3;7-11H2,1-6H3,(H,15,16);15H,7-12H2,1-6H3;7-12H2,1-6H3;13H,4-10H2,1-3H3;7-10H2,1-6H3;1-4H3/t;;;2*12-,13-;;;;;;;;;;;/m...00.........../s1.
What are the key properties of 4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane?
4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane has a molecular weight of 4021.36 g/mol, XLogP of 35.38, 91 rotatable bonds, 8 hydrogen bond donors, and 55 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-9-(3,3-dimethylbutan-2-yl)-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]acetamide;9-tert-butyl-1-oxa-4,9-diazaspiro[5.5]undecane;N-tert-butyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]acetamide;2,2-dimethylpropane;N-[[(1S,4S)-5-(2,2-dimethylpropyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]methyl]-2-methylpropan-2-amine;(1S,4S)-2-(2,2-dimethylpropyl)-5-[(2-methylpropan-2-yl)oxymethyl]-2,5-diazabicyclo[2.2.1]heptane;bis(1-(2,2-dimethylpropyl)-4-[(2-methylpropan-2-yl)oxymethyl]piperazine);bis(N-[[4-(2,2-dimethylpropyl)piperazin-1-yl]methyl]-2-methylpropan-2-amine);2-methyl-N-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]propane;2-methyl-N-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethyl]propan-2-amine;2-methyl-2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propane;2-methyl-2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propane is sourced from PubChem (CID 158306676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).