(3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one

C142H284N24O19 — CID 163773781

IUPAC(3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one
SMILESCC(=O)N1CCCC(CNC(C)(C)C)C1.CC(=O)N1CCC[C@H](CNC(C)(C)C)C1.CC(=O)N1CCOCC1CNC(C)(C)C.CC(=O)N1CCOC[C@@H]1CNC(C)(C)C.CC(=O)N1CCOC[C@H]1CNC(C)(C)C.CC(C)(C)NCC1COCCN1C=O.CC(C)(C)NC[C@@H]1COCCN1C=O.CC(C)(C)NC[C@H]1COCCN1C=O.CC(C)C(=O)N1CCCC(CNC(C)(C)C)C1.CC(C)C(=O)N1CCC[C@@H](CNC(C)(C)C)C1.CC(C)C(=O)N1CCC[C@H](CNC(C)(C)C)C1.CC(C)C(=O)N1CCOC[C@H]1CNC(C)(C)C
InChIInChI=1S/3C14H28N2O.C13H26N2O2.2C12H24N2O.3C11H22N2O2.3C10H20N2O2/c3*1-11(2)13(17)16-8-6-7-12(10-16)9-15-14(3,4)5;1-10(2)12(16)15-6-7-17-9-11(15)8-14-13(3,4)5;2*1-10(15)14-7-5-6-11(9-14)8-13-12(2,3)4;3*1-9(14)13-5-6-15-8-10(13)7-12-11(2,3)4;3*1-10(2,3)11-6-9-7-14-5-4-12(9)8-13/h3*11-12,15H,6-10H2,1-5H3;10-11,14H,6-9H2,1-5H3;2*11,13H,5-9H2,1-4H3;3*10,12H,5-8H2,1-4H3;3*8-9,11H,4-7H2,1-3H3/t2*12-;;2*11-;;2*10-;;2*9-;/m10.11.10.10./s1
InChIKeyMIQROFYTGBGWGQ-VROBWJJNSA-N
MW2631.98 g/mol
LogP13.89
Rot. Bonds31

About (3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one

(3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one (PubChem CID 163773781) has the molecular formula C142H284N24O19 and a molecular weight of 2631.98 g/mol. Its IUPAC name is (3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one.

Molecular Properties

Compound Name(3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one
PubChem CID163773781
Molecular FormulaC142H284N24O19
Molecular Weight2631.98 g/mol
Exact Mass2630.20
IUPAC Name(3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one
SMILESCC(=O)N1CCCC(CNC(C)(C)C)C1.CC(=O)N1CCC[C@H](CNC(C)(C)C)C1.CC(=O)N1CCOCC1CNC(C)(C)C.CC(=O)N1CCOC[C@@H]1CNC(C)(C)C.CC(=O)N1CCOC[C@H]1CNC(C)(C)C.CC(C)(C)NCC1COCCN1C=O.CC(C)(C)NC[C@@H]1COCCN1C=O.CC(C)(C)NC[C@H]1COCCN1C=O.CC(C)C(=O)N1CCCC(CNC(C)(C)C)C1.CC(C)C(=O)N1CCC[C@@H](CNC(C)(C)C)C1.CC(C)C(=O)N1CCC[C@H](CNC(C)(C)C)C1.CC(C)C(=O)N1CCOC[C@H]1CNC(C)(C)C
InChIInChI=1S/3C14H28N2O.C13H26N2O2.2C12H24N2O.3C11H22N2O2.3C10H20N2O2/c3*1-11(2)13(17)16-8-6-7-12(10-16)9-15-14(3,4)5;1-10(2)12(16)15-6-7-17-9-11(15)8-14-13(3,4)5;2*1-10(15)14-7-5-6-11(9-14)8-13-12(2,3)4;3*1-9(14)13-5-6-15-8-10(13)7-12-11(2,3)4;3*1-10(2,3)11-6-9-7-14-5-4-12(9)8-13/h3*11-12,15H,6-10H2,1-5H3;10-11,14H,6-9H2,1-5H3;2*11,13H,5-9H2,1-4H3;3*10,12H,5-8H2,1-4H3;3*8-9,11H,4-7H2,1-3H3/t2*12-;;2*11-;;2*10-;;2*9-;/m10.11.10.10./s1
InChIKeyMIQROFYTGBGWGQ-VROBWJJNSA-N
XLogP13.89
TPSA452.69 Ų
H-Bond Donors12
H-Bond Acceptors31
Rotatable Bonds31
Heavy Atoms185
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002631.98
LogP ≤ 513.89
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

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

Analyze (3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one with MolForge

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Launch Full Analysis

Related Compounds

N-(2-aminoethyl)-N,3-dimethylbutanamide;N-(2-aminoethyl)-3-methylbutanamide;N-(3-aminopropyl)-N-methylpropanamide;N-(3-aminopropyl)propanamide;1-(1,4-diazepan-1-yl)-3-methylbutan-1-one;N-[2-(dimethylamino)ethyl]propanamide;N,3-dimethylbutanamide;ethane;N-ethyl-3-methylbutanamide;N-(2-methoxyethyl)-N-methylpropanamide;N-(2-methoxyethyl)propanamide;N-[3-(methylamino)propyl]propanamide;3-methylbutanamide;3-methyl-N-[2-(methylamino)ethyl]butanamide;N-methyl-N-[2-(methylamino)ethyl]propanamide;1-(4-methylpiperazin-1-yl)propan-1-one;1-morpholin-4-ylpropan-1-one;N-piperidin-4-ylpropanamide;1-piperidin-1-ylpropan-1-one
CID 157229740
1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;4-(2,2-dimethylpropoxy)-1-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine
CID 158331586
2-[2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-N-methylacetamide;2-[2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]ethoxy]-N-methylacetamide;2-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]-N-methylacetamide;2-[2-(2-butoxyethoxy)ethoxy]-N-methylacetamide;2-(2-butoxyethoxy)-N-methylacetamide;1-methyl-4-[2-(4-methylpiperidin-1-yl)ethyl]piperidine;4-methyl-1-[2-(4-methylpiperidin-1-yl)ethyl]piperidine;1-methyl-4-[(4-methylpiperidin-1-yl)methyl]piperidine;1-methyl-4-(4-methylpiperidin-1-yl)piperidine
CID 158538124
N-[2-(diethylamino)ethyl]-2-methylpropanamide;N-[2-(dimethylamino)ethyl]-2-methylpropanamide;N-[1-(dimethylamino)propan-2-yl]-2-methylpropanamide;1,2-dimethyl-4-(2-methylpropyl)piperazine;N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-2-methylpropanamide;N-[2-[ethyl(methyl)amino]ethyl]-2-methylpropanamide;2-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]propanamide;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-4-(2-methylpropyl)piperazine;2-methyl-N-(2-piperidin-1-ylethyl)propanamide;2-methyl-6-piperidin-1-ylhexan-3-one;2-methyl-N-piperidin-3-ylpropanamide;1-[2-(2-methylpropoxy)ethyl]piperidine;1-(2-methylpropyl)-4-propylpiperazine;1,2,2-trimethyl-4-(2-methylpropyl)piperazine
CID 158796046
1-(3-aminoazetidin-1-yl)-2-methylpropan-1-one;N-[2-(diethylamino)ethyl]-2-methylpropanamide;1-[4-(diethylamino)piperidin-1-yl]-2-methylpropan-1-one;N-[2-(dimethylamino)ethyl]-2-methylpropanamide;N-[1-(dimethylamino)propan-2-yl]-2-methylpropanamide;N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-2-methylpropanamide;N-[2-[ethyl(methyl)amino]ethyl]-2-methylpropanamide;2-methylbutane;2-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]propanamide;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-methyl-N-(2-morpholin-4-ylethyl)propanamide;2-methyl-N-(2-piperidin-1-ylethyl)propanamide;2-methyl-6-piperidin-1-ylhexan-3-one;2-methyl-N-piperidin-3-ylpropanamide;1-[2-(2-methylpropoxy)ethyl]piperidine;propan-2-amine
CID 158833060
1-tert-butyl-2,4-dimethylpiperazine;4-tert-butyl-1,3-dimethylpiperazin-2-one;1-(4-tert-butyl-2,6-dimethylpiperazin-1-yl)-2-methoxyethanone;1-tert-butyl-2,5-dimethylpiperidine;1-tert-butyl-3,5-dimethylpiperidine;tris(1-tert-butyl-4-ethylpiperazine);1-(4-tert-butyl-3-methylpiperazin-1-yl)-2-methoxyethanone;1-tert-butyl-2-methylpiperidine;2-(4-tert-butylpiperazin-1-yl)-N,N-dimethylacetamide;1-(4-tert-butylpiperazin-1-yl)-2-methoxyethanone;2-(4-tert-butylpiperazin-1-yl)-N-methylacetamide;4-tert-butyl-1,1,2,6-tetramethylpiperazin-1-ium;4-tert-butyl-1,2,6-trimethylpiperazine;1,4-ditert-butylpiperazine;ethyl 2-(4-tert-butylpiperazin-1-yl)acetate
CID 158934849
(2S,3R)-2-amino-3-methyl-N-(2-morpholin-4-ylethyl)pentanamide;(2R,3R)-2-amino-3-methyl-N-(2-morpholin-4-ylethyl)pentanamide;(2S,3S)-2-amino-3-methyl-N-(2-morpholin-4-ylethyl)pentanamide;(2R,3S)-2-amino-3-methyl-N-(2-morpholin-4-ylethyl)pentanamide
CID 159105749
2-methyl-1-(4-methylpiperazin-1-yl)propan-1-one;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-methyl-1-morpholin-4-ylpropan-1-one;2-methyl-1-piperidin-1-ylpropan-1-one
CID 159299365
1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;N-[3-[2-(4-tert-butylpiperazin-1-yl)ethoxy]propyl]-2-methylpropan-2-amine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;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;2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine
CID 159363779
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;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;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;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine
CID 159615002
N-(2-aminoethyl)-N,3-dimethylbutanamide;N-(2-aminoethyl)-3-methylbutanamide;N-(3-aminopropyl)-N,3-dimethylbutanamide;N-(3-aminopropyl)-3-methylbutanamide;1-(1,4-diazepan-1-yl)-3-methylbutan-1-one;N-[2-(dimethylamino)ethyl]-3-methylbutanamide;N,3-dimethylbutanamide;N,3-dimethyl-N-[2-(methylamino)ethyl]butanamide;N-ethyl-3-methylbutanamide;N-(2-methoxyethyl)-N,3-dimethylbutanamide;N-(2-methoxyethyl)-3-methylbutanamide;3-methylbutanamide;3-methyl-N-[2-(methylamino)ethyl]butanamide;3-methyl-N-[3-(methylamino)propyl]butanamide;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-morpholin-4-ylbutan-1-one;3-methyl-N-piperidin-4-ylbutanamide;3-methyl-1-piperidin-1-ylbutan-1-one
CID 159895882
1-tert-butyl-2,4-dimethylpiperazine;1-tert-butyl-3,5-dimethylpiperazine;4-tert-butyl-1,3-dimethylpiperazin-2-one;1-(4-tert-butyl-2,6-dimethylpiperazin-1-yl)-2-methoxyethanone;1-tert-butyl-2,5-dimethylpiperidine;tris(1-tert-butyl-4-ethylpiperazine);1-(4-tert-butyl-3-methylpiperazin-1-yl)-2-methoxyethanone;1-tert-butyl-2-methylpiperidine;2-(4-tert-butylpiperazin-1-yl)-N,N-dimethylacetamide;1-(4-tert-butylpiperazin-1-yl)-2-methoxyethanone;2-(4-tert-butylpiperazin-1-yl)-N-methylacetamide;4-tert-butyl-1,1,2,6-tetramethylpiperazin-1-ium;4-tert-butyl-1,2,6-trimethylpiperazine;1,4-ditert-butylpiperazine;ethyl 2-(4-tert-butylpiperazin-1-yl)acetate
CID 159945532

Frequently Asked Questions

What is the IUPAC name of (3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one?
The IUPAC name of (3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one (CID 163773781) is (3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one.
What is the SMILES notation for (3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one?
The canonical SMILES for (3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one is CC(=O)N1CCCC(CNC(C)(C)C)C1.CC(=O)N1CCC[C@H](CNC(C)(C)C)C1.CC(=O)N1CCOCC1CNC(C)(C)C.CC(=O)N1CCOC[C@@H]1CNC(C)(C)C.CC(=O)N1CCOC[C@H]1CNC(C)(C)C.CC(C)(C)NCC1COCCN1C=O.CC(C)(C)NC[C@@H]1COCCN1C=O.CC(C)(C)NC[C@H]1COCCN1C=O.CC(C)C(=O)N1CCCC(CNC(C)(C)C)C1.CC(C)C(=O)N1CCC[C@@H](CNC(C)(C)C)C1.CC(C)C(=O)N1CCC[C@H](CNC(C)(C)C)C1.CC(C)C(=O)N1CCOC[C@H]1CNC(C)(C)C.
What is the InChIKey of (3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one?
The InChIKey is MIQROFYTGBGWGQ-VROBWJJNSA-N. The full InChI is InChI=1S/3C14H28N2O.C13H26N2O2.2C12H24N2O.3C11H22N2O2.3C10H20N2O2/c3*1-11(2)13(17)16-8-6-7-12(10-16)9-15-14(3,4)5;1-10(2)12(16)15-6-7-17-9-11(15)8-14-13(3,4)5;2*1-10(15)14-7-5-6-11(9-14)8-13-12(2,3)4;3*1-9(14)13-5-6-15-8-10(13)7-12-11(2,3)4;3*1-10(2,3)11-6-9-7-14-5-4-12(9)8-13/h3*11-12,15H,6-10H2,1-5H3;10-11,14H,6-9H2,1-5H3;2*11,13H,5-9H2,1-4H3;3*10,12H,5-8H2,1-4H3;3*8-9,11H,4-7H2,1-3H3/t2*12-;;2*11-;;2*10-;;2*9-;/m10.11.10.10./s1.
What are the key properties of (3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one?
(3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one has a molecular weight of 2631.98 g/mol, XLogP of 13.89, 31 rotatable bonds, 12 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;(3R)-3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;3-[(tert-butylamino)methyl]morpholine-4-carbaldehyde;1-[(3S)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[3-[(tert-butylamino)methyl]morpholin-4-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]morpholin-4-yl]-2-methylpropan-1-one;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]ethanone;1-[3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3R)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one;1-[(3S)-3-[(tert-butylamino)methyl]piperidin-1-yl]-2-methylpropan-1-one is sourced from PubChem (CID 163773781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).