N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine

C220H438N46O5S — CID 158909212

IUPACN,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine
SMILESC.CC.CC(C)C(C)C.CC(C)C(C)CN(C)C.CC(C)C1CCCN1.CC(C)CC1CCN(C)C1.CC(C)CCC1CCCCN1C.CC(C)CCCc1nccn1C.CC(C)CCCc1nccs1.CC(C)CCCn1cccn1.CC(C)CCN(C)CC(C)(C)C.CC(C)CNCCc1ncccn1.CC(C)NC(=O)OC(C)C.CC(C)NC1CCCCN(C)C1.CC(C)NCC1=CC=NC1.CC(C)NCC1=CN=CC1.CC(C)NCC1=NC=CC1.CC(C)NCc1ccnn1C.CC(C)NCc1ncccn1.CC(C)NCc1nccn1C.CC(C)c1ccc[nH]1.CC(C)c1ccn[nH]1.CC(C)c1ncc[nH]1.CCC(CC)CN(C)CCNC(C)C.CCN(CC)CCC(C)C.COCCNCCC(C)C.Cc1nnc(CNC(C)C)o1.Cc1noc(CNC(C)C)n1
InChIInChI=1S/C12H28N2.C11H23N.C11H25N.C10H17N3.C10H18N2.C10H22N2.C9H16N2.C9H15NS.C9H19N.C9H21N.2C8H15N3.C8H13N3.3C8H14N2.C8H19NO.C8H19N.2C7H13N3O.C7H15NO2.C7H15N.C7H11N.2C6H10N2.C6H14.C2H6.CH4/c1-6-12(7-2)10-14(5)9-8-13-11(3)4;1-10(2)7-8-11-6-4-5-9-12(11)3;1-10(2)7-8-12(6)9-11(3,4)5;1-9(2)8-11-7-4-10-12-5-3-6-13-10;1-9(2)5-4-6-10-11-7-8-12(10)3;1-9(2)11-10-6-4-5-7-12(3)8-10;1-9(2)5-3-7-11-8-4-6-10-11;1-8(2)4-3-5-9-10-6-7-11-9;1-8(2)6-9-4-5-10(3)7-9;1-5-10(6-2)8-7-9(3)4;1-7(2)10-6-8-9-4-5-11(8)3;1-7(2)9-6-8-4-5-10-11(8)3;1-7(2)11-6-8-9-4-3-5-10-8;2*1-7(2)10-6-8-3-4-9-5-8;1-7(2)10-6-8-4-3-5-9-8;1-8(2)4-5-9-6-7-10-3;1-7(2)8(3)6-9(4)5;1-5(2)8-4-7-10-9-6(3)11-7;1-5(2)8-4-7-9-6(3)10-11-7;1-5(2)8-7(9)10-6(3)4;2*1-6(2)7-4-3-5-8-7;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6;1-5(2)6(3)4;1-2;/h11-13H,6-10H2,1-5H3;10-11H,4-9H2,1-3H3;10H,7-9H2,1-6H3;3,5-6,9,11H,4,7-8H2,1-2H3;7-9H,4-6H2,1-3H3;9-11H,4-8H2,1-3H3;4,6,8-9H,3,5,7H2,1-2H3;6-8H,3-5H2,1-2H3;8-9H,4-7H2,1-3H3;9H,5-8H2,1-4H3;4-5,7,10H,6H2,1-3H3;4-5,7,9H,6H2,1-3H3;3-5,7,11H,6H2,1-2H3;4-5,7,10H,3,6H2,1-2H3;3-4,7,10H,5-6H2,1-2H3;3,5,7,10H,4,6H2,1-2H3;8-9H,4-7H2,1-3H3;7-8H,6H2,1-5H3;2*5,8H,4H2,1-3H3;5-6H,1-4H3,(H,8,9);6-8H,3-5H2,1-2H3;3-6,8H,1-2H3;2*3-5H,1-2H3,(H,7,8);5-6H,1-4H3;1-2H3;1H4
InChIKeyJGKSOERYSPZHHS-UHFFFAOYSA-N
MW3840.31 g/mol
LogP46.64
Rot. Bonds81

About N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine

N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine (PubChem CID 158909212) has the molecular formula C220H438N46O5S and a molecular weight of 3840.31 g/mol. Its IUPAC name is N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine.

Molecular Properties

Compound NameN,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine
PubChem CID158909212
Molecular FormulaC220H438N46O5S
Molecular Weight3840.31 g/mol
Exact Mass3837.52
IUPAC NameN,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine
SMILESC.CC.CC(C)C(C)C.CC(C)C(C)CN(C)C.CC(C)C1CCCN1.CC(C)CC1CCN(C)C1.CC(C)CCC1CCCCN1C.CC(C)CCCc1nccn1C.CC(C)CCCc1nccs1.CC(C)CCCn1cccn1.CC(C)CCN(C)CC(C)(C)C.CC(C)CNCCc1ncccn1.CC(C)NC(=O)OC(C)C.CC(C)NC1CCCCN(C)C1.CC(C)NCC1=CC=NC1.CC(C)NCC1=CN=CC1.CC(C)NCC1=NC=CC1.CC(C)NCc1ccnn1C.CC(C)NCc1ncccn1.CC(C)NCc1nccn1C.CC(C)c1ccc[nH]1.CC(C)c1ccn[nH]1.CC(C)c1ncc[nH]1.CCC(CC)CN(C)CCNC(C)C.CCN(CC)CCC(C)C.COCCNCCC(C)C.Cc1nnc(CNC(C)C)o1.Cc1noc(CNC(C)C)n1
InChIInChI=1S/C12H28N2.C11H23N.C11H25N.C10H17N3.C10H18N2.C10H22N2.C9H16N2.C9H15NS.C9H19N.C9H21N.2C8H15N3.C8H13N3.3C8H14N2.C8H19NO.C8H19N.2C7H13N3O.C7H15NO2.C7H15N.C7H11N.2C6H10N2.C6H14.C2H6.CH4/c1-6-12(7-2)10-14(5)9-8-13-11(3)4;1-10(2)7-8-11-6-4-5-9-12(11)3;1-10(2)7-8-12(6)9-11(3,4)5;1-9(2)8-11-7-4-10-12-5-3-6-13-10;1-9(2)5-4-6-10-11-7-8-12(10)3;1-9(2)11-10-6-4-5-7-12(3)8-10;1-9(2)5-3-7-11-8-4-6-10-11;1-8(2)4-3-5-9-10-6-7-11-9;1-8(2)6-9-4-5-10(3)7-9;1-5-10(6-2)8-7-9(3)4;1-7(2)10-6-8-9-4-5-11(8)3;1-7(2)9-6-8-4-5-10-11(8)3;1-7(2)11-6-8-9-4-3-5-10-8;2*1-7(2)10-6-8-3-4-9-5-8;1-7(2)10-6-8-4-3-5-9-8;1-8(2)4-5-9-6-7-10-3;1-7(2)8(3)6-9(4)5;1-5(2)8-4-7-10-9-6(3)11-7;1-5(2)8-4-7-9-6(3)10-11-7;1-5(2)8-7(9)10-6(3)4;2*1-6(2)7-4-3-5-8-7;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6;1-5(2)6(3)4;1-2;/h11-13H,6-10H2,1-5H3;10-11H,4-9H2,1-3H3;10H,7-9H2,1-6H3;3,5-6,9,11H,4,7-8H2,1-2H3;7-9H,4-6H2,1-3H3;9-11H,4-8H2,1-3H3;4,6,8-9H,3,5,7H2,1-2H3;6-8H,3-5H2,1-2H3;8-9H,4-7H2,1-3H3;9H,5-8H2,1-4H3;4-5,7,10H,6H2,1-3H3;4-5,7,9H,6H2,1-3H3;3-5,7,11H,6H2,1-2H3;4-5,7,10H,3,6H2,1-2H3;3-4,7,10H,5-6H2,1-2H3;3,5,7,10H,4,6H2,1-2H3;8-9H,4-7H2,1-3H3;7-8H,6H2,1-5H3;2*5,8H,4H2,1-3H3;5-6H,1-4H3,(H,8,9);6-8H,3-5H2,1-2H3;3-6,8H,1-2H3;2*3-5H,1-2H3,(H,7,8);5-6H,1-4H3;1-2H3;1H4
InChIKeyJGKSOERYSPZHHS-UHFFFAOYSA-N
XLogP46.64
TPSA550.43 Ų
H-Bond Donors17
H-Bond Acceptors48
Rotatable Bonds81
Heavy Atoms272
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003840.31
LogP ≤ 546.64
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1048

Computed Properties (RDKit)

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

Analyze N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine?
The IUPAC name of N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine (CID 158909212) is N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine.
What is the SMILES notation for N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine?
The canonical SMILES for N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine is C.CC.CC(C)C(C)C.CC(C)C(C)CN(C)C.CC(C)C1CCCN1.CC(C)CC1CCN(C)C1.CC(C)CCC1CCCCN1C.CC(C)CCCc1nccn1C.CC(C)CCCc1nccs1.CC(C)CCCn1cccn1.CC(C)CCN(C)CC(C)(C)C.CC(C)CNCCc1ncccn1.CC(C)NC(=O)OC(C)C.CC(C)NC1CCCCN(C)C1.CC(C)NCC1=CC=NC1.CC(C)NCC1=CN=CC1.CC(C)NCC1=NC=CC1.CC(C)NCc1ccnn1C.CC(C)NCc1ncccn1.CC(C)NCc1nccn1C.CC(C)c1ccc[nH]1.CC(C)c1ccn[nH]1.CC(C)c1ncc[nH]1.CCC(CC)CN(C)CCNC(C)C.CCN(CC)CCC(C)C.COCCNCCC(C)C.Cc1nnc(CNC(C)C)o1.Cc1noc(CNC(C)C)n1.
What is the InChIKey of N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine?
The InChIKey is JGKSOERYSPZHHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2.C11H23N.C11H25N.C10H17N3.C10H18N2.C10H22N2.C9H16N2.C9H15NS.C9H19N.C9H21N.2C8H15N3.C8H13N3.3C8H14N2.C8H19NO.C8H19N.2C7H13N3O.C7H15NO2.C7H15N.C7H11N.2C6H10N2.C6H14.C2H6.CH4/c1-6-12(7-2)10-14(5)9-8-13-11(3)4;1-10(2)7-8-11-6-4-5-9-12(11)3;1-10(2)7-8-12(6)9-11(3,4)5;1-9(2)8-11-7-4-10-12-5-3-6-13-10;1-9(2)5-4-6-10-11-7-8-12(10)3;1-9(2)11-10-6-4-5-7-12(3)8-10;1-9(2)5-3-7-11-8-4-6-10-11;1-8(2)4-3-5-9-10-6-7-11-9;1-8(2)6-9-4-5-10(3)7-9;1-5-10(6-2)8-7-9(3)4;1-7(2)10-6-8-9-4-5-11(8)3;1-7(2)9-6-8-4-5-10-11(8)3;1-7(2)11-6-8-9-4-3-5-10-8;2*1-7(2)10-6-8-3-4-9-5-8;1-7(2)10-6-8-4-3-5-9-8;1-8(2)4-5-9-6-7-10-3;1-7(2)8(3)6-9(4)5;1-5(2)8-4-7-10-9-6(3)11-7;1-5(2)8-4-7-9-6(3)10-11-7;1-5(2)8-7(9)10-6(3)4;2*1-6(2)7-4-3-5-8-7;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6;1-5(2)6(3)4;1-2;/h11-13H,6-10H2,1-5H3;10-11H,4-9H2,1-3H3;10H,7-9H2,1-6H3;3,5-6,9,11H,4,7-8H2,1-2H3;7-9H,4-6H2,1-3H3;9-11H,4-8H2,1-3H3;4,6,8-9H,3,5,7H2,1-2H3;6-8H,3-5H2,1-2H3;8-9H,4-7H2,1-3H3;9H,5-8H2,1-4H3;4-5,7,10H,6H2,1-3H3;4-5,7,9H,6H2,1-3H3;3-5,7,11H,6H2,1-2H3;4-5,7,10H,3,6H2,1-2H3;3-4,7,10H,5-6H2,1-2H3;3,5,7,10H,4,6H2,1-2H3;8-9H,4-7H2,1-3H3;7-8H,6H2,1-5H3;2*5,8H,4H2,1-3H3;5-6H,1-4H3,(H,8,9);6-8H,3-5H2,1-2H3;3-6,8H,1-2H3;2*3-5H,1-2H3,(H,7,8);5-6H,1-4H3;1-2H3;1H4.
What are the key properties of N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine?
N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine has a molecular weight of 3840.31 g/mol, XLogP of 46.64, 81 rotatable bonds, 17 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-methylbutan-1-amine;2,3-dimethylbutane;N-(2,2-dimethylpropyl)-N,3-dimethylbutan-1-amine;ethane;N'-(2-ethylbutyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine;methane;N-(2-methoxyethyl)-3-methylbutan-1-amine;N-[(1-methylimidazol-2-yl)methyl]propan-2-amine;1-methyl-2-(3-methylbutyl)piperidine;1-methyl-2-(4-methylpentyl)imidazole;1-methyl-3-(2-methylpropyl)pyrrolidine;N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine;N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine;1-(4-methylpentyl)pyrazole;2-(4-methylpentyl)-1,3-thiazole;1-methyl-N-propan-2-ylazepan-3-amine;N-[(2-methylpyrazol-3-yl)methyl]propan-2-amine;2-methyl-N-(2-pyrimidin-2-ylethyl)propan-1-amine;2-propan-2-yl-1H-imidazole;propan-2-yl N-propan-2-ylcarbamate;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole;2-propan-2-ylpyrrolidine;N-(pyrimidin-2-ylmethyl)propan-2-amine;N-(2H-pyrrol-3-ylmethyl)propan-2-amine;N-(3H-pyrrol-2-ylmethyl)propan-2-amine;N-(3H-pyrrol-4-ylmethyl)propan-2-amine;N,N,2,3-tetramethylbutan-1-amine is sourced from PubChem (CID 158909212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).