1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol

C202H415N37O13 — CID 167650234

IUPAC1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol
SMILESCC(C)(C)C(=O)N1CCC(N2CCOCC2)CC1.CC(C)(C)C(=O)N1CCN(CCO)CC1.CC(C)(C)C(=O)N1CCOCC1.CC(C)(C)N1CCC(N2CCN(C3CC3)CC2)CC1.CC(C)(C)N1CCC(N2CCN(CCO)CC2)CC1.CC(C)(C)N1CCN(CCO)CC1.CC(C)(C)OC1CCN(CCO)C1.CCN1CCN(C(C)(C)C)CC1.CCN1CCN(C2CCN(C(C)(C)C)CC2)CC1.CN(C)C1CCN(C(C)(C)C)C1.CN(C)C1CCN(C(C)(C)C)CC1.CN1CC2CC1CN2C(C)(C)C.CN1CCC(NC(=O)C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.CN1CCN(C2CCN(C(=O)C(C)(C)C)CC2)CC1.CN1CCN(C2CCN(C(C)(C)C)CC2)CC1.CN1CCN(CCCOC(C)(C)C)CC1
InChIInChI=1S/C16H31N3.C15H29N3O.C15H31N3O.C15H31N3.C14H29N3.C14H26N2O2.C12H26N2O.C11H22N2O2.C11H22N2O.C11H24N2.C10H22N2O.C10H20N2.2C10H22N2.C10H21NO2.C9H20N2.C9H17NO2/c1-16(2,3)19-8-6-15(7-9-19)18-12-10-17(11-13-18)14-4-5-14;1-15(2,3)14(19)18-7-5-13(6-8-18)17-11-9-16(4)10-12-17;1-15(2,3)18-6-4-14(5-7-18)17-10-8-16(9-11-17)12-13-19;1-5-16-10-12-17(13-11-16)14-6-8-18(9-7-14)15(2,3)4;1-14(2,3)17-7-5-13(6-8-17)16-11-9-15(4)10-12-16;1-14(2,3)13(17)16-6-4-12(5-7-16)15-8-10-18-11-9-15;1-12(2,3)15-11-5-6-14-9-7-13(4)8-10-14;1-11(2,3)10(15)13-6-4-12(5-7-13)8-9-14;1-11(2,3)10(14)12-9-5-7-13(4)8-6-9;1-11(2,3)13-8-6-10(7-9-13)12(4)5;1-10(2,3)12-6-4-11(5-7-12)8-9-13;1-10(2,3)12-7-8-5-9(12)6-11(8)4;1-10(2,3)12-7-6-9(8-12)11(4)5;1-5-11-6-8-12(9-7-11)10(2,3)4;1-10(2,3)13-9-4-5-11(8-9)6-7-12;1-9(2,3)11-7-5-10(4)6-8-11;1-9(2,3)8(11)10-4-6-12-7-5-10/h14-15H,4-13H2,1-3H3;13H,5-12H2,1-4H3;14,19H,4-13H2,1-3H3;14H,5-13H2,1-4H3;13H,5-12H2,1-4H3;12H,4-11H2,1-3H3;5-11H2,1-4H3;14H,4-9H2,1-3H3;9H,5-8H2,1-4H3,(H,12,14);10H,6-9H2,1-5H3;13H,4-9H2,1-3H3;8-9H,5-7H2,1-4H3;9H,6-8H2,1-5H3;5-9H2,1-4H3;9,12H,4-8H2,1-3H3;5-8H2,1-4H3;4-7H2,1-3H3
InChIKeyQLVXBEQPINLBOR-UHFFFAOYSA-N
MW3570.79 g/mol
LogP20.76
Rot. Bonds25

About 1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol

1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol (PubChem CID 167650234) has the molecular formula C202H415N37O13 and a molecular weight of 3570.79 g/mol. Its IUPAC name is 1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol.

Molecular Properties

Compound Name1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol
PubChem CID167650234
Molecular FormulaC202H415N37O13
Molecular Weight3570.79 g/mol
Exact Mass3568.30
IUPAC Name1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol
SMILESCC(C)(C)C(=O)N1CCC(N2CCOCC2)CC1.CC(C)(C)C(=O)N1CCN(CCO)CC1.CC(C)(C)C(=O)N1CCOCC1.CC(C)(C)N1CCC(N2CCN(C3CC3)CC2)CC1.CC(C)(C)N1CCC(N2CCN(CCO)CC2)CC1.CC(C)(C)N1CCN(CCO)CC1.CC(C)(C)OC1CCN(CCO)C1.CCN1CCN(C(C)(C)C)CC1.CCN1CCN(C2CCN(C(C)(C)C)CC2)CC1.CN(C)C1CCN(C(C)(C)C)C1.CN(C)C1CCN(C(C)(C)C)CC1.CN1CC2CC1CN2C(C)(C)C.CN1CCC(NC(=O)C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.CN1CCN(C2CCN(C(=O)C(C)(C)C)CC2)CC1.CN1CCN(C2CCN(C(C)(C)C)CC2)CC1.CN1CCN(CCCOC(C)(C)C)CC1
InChIInChI=1S/C16H31N3.C15H29N3O.C15H31N3O.C15H31N3.C14H29N3.C14H26N2O2.C12H26N2O.C11H22N2O2.C11H22N2O.C11H24N2.C10H22N2O.C10H20N2.2C10H22N2.C10H21NO2.C9H20N2.C9H17NO2/c1-16(2,3)19-8-6-15(7-9-19)18-12-10-17(11-13-18)14-4-5-14;1-15(2,3)14(19)18-7-5-13(6-8-18)17-11-9-16(4)10-12-17;1-15(2,3)18-6-4-14(5-7-18)17-10-8-16(9-11-17)12-13-19;1-5-16-10-12-17(13-11-16)14-6-8-18(9-7-14)15(2,3)4;1-14(2,3)17-7-5-13(6-8-17)16-11-9-15(4)10-12-16;1-14(2,3)13(17)16-6-4-12(5-7-16)15-8-10-18-11-9-15;1-12(2,3)15-11-5-6-14-9-7-13(4)8-10-14;1-11(2,3)10(15)13-6-4-12(5-7-13)8-9-14;1-11(2,3)10(14)12-9-5-7-13(4)8-6-9;1-11(2,3)13-8-6-10(7-9-13)12(4)5;1-10(2,3)12-6-4-11(5-7-12)8-9-13;1-10(2,3)12-7-8-5-9(12)6-11(8)4;1-10(2,3)12-7-6-9(8-12)11(4)5;1-5-11-6-8-12(9-7-11)10(2,3)4;1-10(2,3)13-9-4-5-11(8-9)6-7-12;1-9(2,3)11-7-5-10(4)6-8-11;1-9(2,3)8(11)10-4-6-12-7-5-10/h14-15H,4-13H2,1-3H3;13H,5-12H2,1-4H3;14,19H,4-13H2,1-3H3;14H,5-13H2,1-4H3;13H,5-12H2,1-4H3;12H,4-11H2,1-3H3;5-11H2,1-4H3;14H,4-9H2,1-3H3;9H,5-8H2,1-4H3,(H,12,14);10H,6-9H2,1-5H3;13H,4-9H2,1-3H3;8-9H,5-7H2,1-4H3;9H,6-8H2,1-5H3;5-9H2,1-4H3;9,12H,4-8H2,1-3H3;5-8H2,1-4H3;4-7H2,1-3H3
InChIKeyQLVXBEQPINLBOR-UHFFFAOYSA-N
XLogP20.76
TPSA331.86 Ų
H-Bond Donors5
H-Bond Acceptors45
Rotatable Bonds25
Heavy Atoms252
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003570.79
LogP ≤ 520.76
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1045

Computed Properties (RDKit)

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

Analyze 1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol with MolForge

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Launch Full Analysis

Related Compounds

bis(N-tert-butylpyrrolidin-3-amine);bis(N-(cyclopentylmethyl)-2-methylpropan-2-amine);2,2-dimethyl-1-piperazin-1-ylpropan-1-one;4-(2,2-dimethylpropyl)morpholine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine;1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidine;4-[(2-methylpropan-2-yl)oxy]piperidine;2-methyl-N-(2-pyrrolidin-1-ylethyl)propan-2-amine
CID 157137617
N-tert-butyl-N',N'-diethyl-N-methylethane-1,2-diamine;(1-tert-butylpyrrolidin-3-yl)methanol;4-cyclopropylpiperidine;2,2-dimethyl-1-(4-methylpiperazin-1-yl)propan-1-one;N,N-dimethylpiperidin-4-amine;1-(2,2-dimethylpropyl)-N,N-dimethylpiperidin-4-amine;1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;1-(2,2-dimethylpropyl)-4-(4-methylpiperazin-1-yl)piperazine;1-(2,2-dimethylpropyl)-3-methylpyrrolidin-3-ol;1-(2,2-dimethylpropyl)-4-(oxetan-3-yl)piperazine;1-(2,2-dimethylpropyl)piperazine;2-[[1-(2,2-dimethylpropyl)piperidin-4-yl]-methylamino]ethanol;[1-(2,2-dimethylpropyl)pyrrolidin-3-yl]methanol;1-methylpiperazine;heptakis(2-methylpropane);3-methylpyrrolidin-3-ol;1-(oxetan-3-yl)piperazine;piperazine;2-piperazin-1-ylethanol
CID 157376562
N-tert-butyl-N',N'-diethyl-N-methylethane-1,2-diamine;(1-tert-butylpyrrolidin-3-yl)methanol;1-cyclopropylpiperazine;2,2-dimethyl-1-(4-methylpiperazin-1-yl)propan-1-one;N,N-dimethylpiperidin-4-amine;1-(2,2-dimethylpropyl)-N,N-dimethylpiperidin-4-amine;1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;1-(2,2-dimethylpropyl)-3-methylpyrrolidin-3-ol;1-(2,2-dimethylpropyl)piperazine;2-[[1-(2,2-dimethylpropyl)piperidin-4-yl]-methylamino]ethanol;[1-(2,2-dimethylpropyl)pyrrolidin-3-yl]methanol;3,3-dimethylpyrrolidine;methane;1-methylpiperazine;heptakis(2-methylpropane);1-(oxetan-3-yl)piperazine;piperazine;2-piperazin-1-ylethanol
CID 158241989
1-tert-butyl-4-(2-isocyanoethyl)piperazine;1-tert-butyl-4-(2-methoxyethyl)piperazine;2-(4-tert-butylpiperazin-1-yl)-N,N-dimethylethanamine;1-(4-tert-butylpiperazin-1-yl)ethanone;4-[2-(4-tert-butylpiperazin-1-yl)ethyl]morpholine;(3S)-1-tert-butylpiperidin-3-ol;(3R)-1-(1-tert-butylpiperidin-4-yl)pyrrolidin-3-ol;(3S)-1-(1-tert-butylpiperidin-4-yl)pyrrolidin-3-ol;4-[(3R)-1-tert-butylpyrrolidin-3-yl]morpholine;1-[(3R)-1-tert-butylpyrrolidin-3-yl]piperazine
CID 159031508
1-tert-butyl-4-cyclopropylpiperazine;N-tert-butyl-N',N'-diethyl-N-methylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-3,3-dimethylpyrrolidine;1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-(oxetan-3-yl)piperazine;1-tert-butylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;(1-tert-butylpyrrolidin-3-yl)methanol;2,2-dimethyl-1-(4-methylpiperazin-1-yl)propan-1-one;1-(2,2-dimethylpropyl)-N,N-dimethylpiperidin-4-amine;1-(2,2-dimethylpropyl)-4-ethylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperazine;1-(2,2-dimethylpropyl)-4-(4-methylpiperazin-1-yl)piperazine;1-(2,2-dimethylpropyl)-3-methylpyrrolidin-3-ol;1-(2,2-dimethylpropyl)-4-(oxetan-3-yl)piperazine;1-(2,2-dimethylpropyl)piperazine;2-[[1-(2,2-dimethylpropyl)piperidin-4-yl]-methylamino]ethanol;[1-(2,2-dimethylpropyl)pyrrolidin-3-yl]methanol
CID 160611314
(1S,4S)-2,5-bis[2-[(2-methylpropan-2-yl)oxy]ethyl]-2,5-diazabicyclo[2.2.1]heptane;(1R,4R)-2,5-bis[2-[(2-methylpropan-2-yl)oxy]ethyl]-2,5-diazabicyclo[2.2.1]heptane;1,4-bis[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-tert-butyl-4-[2-[4-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxyethyl]piperazine;N-tert-butyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-amine;N-(2,2-dimethylpropyl)-2-[4-[1-[(2-methylpropan-2-yl)oxy]propan-2-yl]piperazin-1-yl]acetamide
CID 161193108
bis(N-tert-butylpyrrolidin-3-amine);2,2-dimethyl-1-piperazin-1-ylpropan-1-one;4-(2,2-dimethylpropyl)morpholine;4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholine;1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;4-[(2-methylpropan-2-yl)oxy]piperidine
CID 161344762
bis(2,6-bis[2-[(2-methylpropan-2-yl)oxy]ethyl]-2,6-diazaspiro[3.3]heptane);1,4-bis[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;2-(tert-butylamino)-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethanone;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;(1R,4R)-2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;(1S,4S)-2,5-ditert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine
CID 161617387
2-hydroxy-N-[1-(2-methylpropyl)piperidin-4-yl]acetamide;2-hydroxy-N-[(3R)-1-(2-methylpropyl)pyrrolidin-3-yl]acetamide;4-methoxy-1-(2-methylpropyl)piperidine;[4-(2-methylpropyl)morpholin-2-yl]methanamine;[(2R)-1-(2-methylpropyl)piperazin-2-yl]methanol;[(2S)-1-(2-methylpropyl)piperazin-2-yl]methanol;(2S)-1-(2-methylpropyl)pyrrolidin-2-amine;(2R)-1-(2-methylpropyl)pyrrolidin-2-amine;N-[(3R)-1-(2-methylpropyl)pyrrolidin-3-yl]cyclopropanecarboxamide
CID 167595298

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol?
The IUPAC name of 1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol (CID 167650234) is 1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol.
What is the SMILES notation for 1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol?
The canonical SMILES for 1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol is CC(C)(C)C(=O)N1CCC(N2CCOCC2)CC1.CC(C)(C)C(=O)N1CCN(CCO)CC1.CC(C)(C)C(=O)N1CCOCC1.CC(C)(C)N1CCC(N2CCN(C3CC3)CC2)CC1.CC(C)(C)N1CCC(N2CCN(CCO)CC2)CC1.CC(C)(C)N1CCN(CCO)CC1.CC(C)(C)OC1CCN(CCO)C1.CCN1CCN(C(C)(C)C)CC1.CCN1CCN(C2CCN(C(C)(C)C)CC2)CC1.CN(C)C1CCN(C(C)(C)C)C1.CN(C)C1CCN(C(C)(C)C)CC1.CN1CC2CC1CN2C(C)(C)C.CN1CCC(NC(=O)C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.CN1CCN(C2CCN(C(=O)C(C)(C)C)CC2)CC1.CN1CCN(C2CCN(C(C)(C)C)CC2)CC1.CN1CCN(CCCOC(C)(C)C)CC1.
What is the InChIKey of 1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol?
The InChIKey is QLVXBEQPINLBOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3.C15H29N3O.C15H31N3O.C15H31N3.C14H29N3.C14H26N2O2.C12H26N2O.C11H22N2O2.C11H22N2O.C11H24N2.C10H22N2O.C10H20N2.2C10H22N2.C10H21NO2.C9H20N2.C9H17NO2/c1-16(2,3)19-8-6-15(7-9-19)18-12-10-17(11-13-18)14-4-5-14;1-15(2,3)14(19)18-7-5-13(6-8-18)17-11-9-16(4)10-12-17;1-15(2,3)18-6-4-14(5-7-18)17-10-8-16(9-11-17)12-13-19;1-5-16-10-12-17(13-11-16)14-6-8-18(9-7-14)15(2,3)4;1-14(2,3)17-7-5-13(6-8-17)16-11-9-15(4)10-12-16;1-14(2,3)13(17)16-6-4-12(5-7-16)15-8-10-18-11-9-15;1-12(2,3)15-11-5-6-14-9-7-13(4)8-10-14;1-11(2,3)10(15)13-6-4-12(5-7-13)8-9-14;1-11(2,3)10(14)12-9-5-7-13(4)8-6-9;1-11(2,3)13-8-6-10(7-9-13)12(4)5;1-10(2,3)12-6-4-11(5-7-12)8-9-13;1-10(2,3)12-7-8-5-9(12)6-11(8)4;1-10(2,3)12-7-6-9(8-12)11(4)5;1-5-11-6-8-12(9-7-11)10(2,3)4;1-10(2,3)13-9-4-5-11(8-9)6-7-12;1-9(2,3)11-7-5-10(4)6-8-11;1-9(2,3)8(11)10-4-6-12-7-5-10/h14-15H,4-13H2,1-3H3;13H,5-12H2,1-4H3;14,19H,4-13H2,1-3H3;14H,5-13H2,1-4H3;13H,5-12H2,1-4H3;12H,4-11H2,1-3H3;5-11H2,1-4H3;14H,4-9H2,1-3H3;9H,5-8H2,1-4H3,(H,12,14);10H,6-9H2,1-5H3;13H,4-9H2,1-3H3;8-9H,5-7H2,1-4H3;9H,6-8H2,1-5H3;5-9H2,1-4H3;9,12H,4-8H2,1-3H3;5-8H2,1-4H3;4-7H2,1-3H3.
What are the key properties of 1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol?
1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol has a molecular weight of 3570.79 g/mol, XLogP of 20.76, 25 rotatable bonds, 5 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-N,N-dimethylpyrrolidin-3-amine;1-tert-butyl-4-ethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;1-tert-butyl-4-methylpiperazine;2-(4-tert-butylpiperazin-1-yl)ethanol;1-(1-tert-butylpiperidin-4-yl)-4-cyclopropylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-ethylpiperazine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;2-[4-(1-tert-butylpiperidin-4-yl)piperazin-1-yl]ethanol;2,2-dimethyl-1-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]propan-1-one;2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide;2,2-dimethyl-1-(4-morpholin-4-ylpiperidin-1-yl)propan-1-one;2,2-dimethyl-1-morpholin-4-ylpropan-1-one;1-[4-(2-hydroxyethyl)piperazin-1-yl]-2,2-dimethylpropan-1-one;1-methyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine;2-[3-[(2-methylpropan-2-yl)oxy]pyrrolidin-1-yl]ethanol is sourced from PubChem (CID 167650234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).