2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine

C147H328N22O11S — CID 161294474

IUPAC2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C#CCNC(C)(C)C.CC(C)(C)NC1CC2CCC1C2.CC(C)(C)NCCCCCC(=O)O.CC(C)(C)NCCCN1CCOCC1.CC(C)(C)NCCCn1ccnc1.CC(C)(C)NCCN1CCOCC1.CC(C)(C)NCCO.CC(C)(C)NCc1cccc(S(C)(=O)=O)c1.CC(C)(C)NCc1cccnc1.CC(C)(C)NN.CC(C)(C)N[C@H]1CCCC[C@@H]1N.CCNC(C)(C)C.CCOC(=O)c1ccc(CNC(C)(C)C)o1.CN(C)CCN(C)C(C)(C)C.COC(C)(C)C
InChIInChI=1S/C12H19NO3.C12H19NO2S.C11H24N2O.C11H21N.C10H19N3.C10H22N2O.C10H16N2.C10H22N2.C10H21NO2.C9H22N2.C7H13N.C6H15NO.C6H15N.C5H12O.C4H12N2.14CH4/c1-5-15-11(14)10-7-6-9(16-10)8-13-12(2,3)4;1-12(2,3)13-9-10-6-5-7-11(8-10)16(4,14)15;1-11(2,3)12-5-4-6-13-7-9-14-10-8-13;1-11(2,3)12-10-7-8-4-5-9(10)6-8;1-10(2,3)12-5-4-7-13-8-6-11-9-13;1-10(2,3)11-4-5-12-6-8-13-9-7-12;1-10(2,3)12-8-9-5-4-6-11-7-9;1-10(2,3)12-9-7-5-4-6-8(9)11;1-10(2,3)11-8-6-4-5-7-9(12)13;1-9(2,3)11(6)8-7-10(4)5;1-5-6-8-7(2,3)4;1-6(2,3)7-4-5-8;1-5-7-6(2,3)4;1-5(2,3)6-4;1-4(2,3)6-5;;;;;;;;;;;;;;/h6-7,13H,5,8H2,1-4H3;5-8,13H,9H2,1-4H3;12H,4-10H2,1-3H3;8-10,12H,4-7H2,1-3H3;6,8-9,12H,4-5,7H2,1-3H3;11H,4-9H2,1-3H3;4-7,12H,8H2,1-3H3;8-9,12H,4-7,11H2,1-3H3;11H,4-8H2,1-3H3,(H,12,13);7-8H2,1-6H3;1,8H,6H2,2-4H3;7-8H,4-5H2,1-3H3;7H,5H2,1-4H3;1-4H3;6H,5H2,1-3H3;14*1H4/t;;;;;;;8-,9-;;;;;;;;;;;;;;;;;;;;;/m.......0...................../s1
InChIKeyVGUFGZLRFHSVTQ-JGUPIDMPSA-N
MW2612.45 g/mol
LogP30.62
Rot. Bonds35

About 2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine

2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine (PubChem CID 161294474) has the molecular formula C147H328N22O11S and a molecular weight of 2612.45 g/mol. Its IUPAC name is 2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine.

Molecular Properties

Compound Name2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine
PubChem CID161294474
Molecular FormulaC147H328N22O11S
Molecular Weight2612.45 g/mol
Exact Mass2610.55
IUPAC Name2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C#CCNC(C)(C)C.CC(C)(C)NC1CC2CCC1C2.CC(C)(C)NCCCCCC(=O)O.CC(C)(C)NCCCN1CCOCC1.CC(C)(C)NCCCn1ccnc1.CC(C)(C)NCCN1CCOCC1.CC(C)(C)NCCO.CC(C)(C)NCc1cccc(S(C)(=O)=O)c1.CC(C)(C)NCc1cccnc1.CC(C)(C)NN.CC(C)(C)N[C@H]1CCCC[C@@H]1N.CCNC(C)(C)C.CCOC(=O)c1ccc(CNC(C)(C)C)o1.CN(C)CCN(C)C(C)(C)C.COC(C)(C)C
InChIInChI=1S/C12H19NO3.C12H19NO2S.C11H24N2O.C11H21N.C10H19N3.C10H22N2O.C10H16N2.C10H22N2.C10H21NO2.C9H22N2.C7H13N.C6H15NO.C6H15N.C5H12O.C4H12N2.14CH4/c1-5-15-11(14)10-7-6-9(16-10)8-13-12(2,3)4;1-12(2,3)13-9-10-6-5-7-11(8-10)16(4,14)15;1-11(2,3)12-5-4-6-13-7-9-14-10-8-13;1-11(2,3)12-10-7-8-4-5-9(10)6-8;1-10(2,3)12-5-4-7-13-8-6-11-9-13;1-10(2,3)11-4-5-12-6-8-13-9-7-12;1-10(2,3)12-8-9-5-4-6-11-7-9;1-10(2,3)12-9-7-5-4-6-8(9)11;1-10(2,3)11-8-6-4-5-7-9(12)13;1-9(2,3)11(6)8-7-10(4)5;1-5-6-8-7(2,3)4;1-6(2,3)7-4-5-8;1-5-7-6(2,3)4;1-5(2,3)6-4;1-4(2,3)6-5;;;;;;;;;;;;;;/h6-7,13H,5,8H2,1-4H3;5-8,13H,9H2,1-4H3;12H,4-10H2,1-3H3;8-10,12H,4-7H2,1-3H3;6,8-9,12H,4-5,7H2,1-3H3;11H,4-9H2,1-3H3;4-7,12H,8H2,1-3H3;8-9,12H,4-7,11H2,1-3H3;11H,4-8H2,1-3H3,(H,12,13);7-8H2,1-6H3;1,8H,6H2,2-4H3;7-8H,4-5H2,1-3H3;7H,5H2,1-4H3;1-4H3;6H,5H2,1-3H3;14*1H4/t;;;;;;;8-,9-;;;;;;;;;;;;;;;;;;;;;/m.......0...................../s1
InChIKeyVGUFGZLRFHSVTQ-JGUPIDMPSA-N
XLogP30.62
TPSA410.90 Ų
H-Bond Donors17
H-Bond Acceptors32
Rotatable Bonds35
Heavy Atoms181
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002612.45
LogP ≤ 530.62
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine with MolForge

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Launch Full Analysis

Related Compounds

N-benzyl-2-methylpropan-2-amine;4-(tert-butylamino)cyclohexan-1-ol;2-(tert-butylamino)ethanol;N-tert-butylcyclopentanamine;N-tert-butyl-6-methylpyridin-3-amine;N-tert-butylpyridin-3-amine;N,2-dimethylpropan-2-amine;ethane;4-(4-ethylpiperazin-1-yl)-N-propan-2-ylaniline;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;N-[3-(2-iodoethyliodanuidyl)propyl]-2-methylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-(2-piperidin-1-ylethyl)propan-2-amine;2-methylpropan-2-amine;2-methyl-N-propan-2-ylpropan-2-amine;2-methyl-N-(pyridin-2-ylmethyl)propan-2-amine;2-methyl-N-(pyridin-4-ylmethyl)propan-2-amine;4-(2-morpholin-4-ylethyl)-N-propan-2-ylaniline;N-propan-2-ylcyclopropanamine
CID 159048850
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-4-methylbenzamide;ethyl 4-[(4-methylbenzoyl)amino]piperidine-1-carboxylate;N-(2-hydroxyethyl)-4-methylbenzamide;N-(3-imidazol-1-ylpropyl)-4-methylbenzamide;N-(2-methoxyethyl)-3-methylbenzamide;4-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide;3-methyl-N-(2-morpholin-4-ylethyl)benzamide;4-methyl-N-(3-morpholin-4-ylpropyl)benzamide;4-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 159175234
cis-methyl (1R,2S)-2-[[5-(imidazol-1-ylmethyl)furan-2-carbonyl]amino]cycloheptane-1-carboxylate
CID 97053856
5-[[cyclohexyl-[(3-methoxyphenyl)methyl]amino]methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide
CID 3353343
methyl (1S,2R,3R,4S)-3-[[5-(imidazol-1-ylmethyl)furan-2-carbonyl]amino]bicyclo[2.2.1]heptane-2-carboxylate
CID 129432761
methyl (1S,2S,3S,4S)-3-[[5-(imidazol-1-ylmethyl)furan-2-carbonyl]amino]bicyclo[2.2.1]heptane-2-carboxylate
CID 98515091
3-imidazol-1-yl-N-[[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]methyl]propan-1-amine
CID 17216138
1-(3-morpholin-4-ylpropyl)-3-(pyridin-3-ylmethyl)urea
CID 127566290
1-ethyl-2-[[3-(imidazol-1-ylmethyl)phenyl]methyl]-3-(3-morpholin-4-ylpropyl)guanidine
CID 110971575
3-imidazol-1-yl-N-(pyridin-3-ylmethyl)propan-1-amine;oxalic acid
CID 17052847
N-(2-morpholin-4-ylethyl)-5-(pyridin-3-ylmethylamino)pyrazine-2-carboxamide
CID 109277480
1-[6-[cyclohexyl(2-morpholin-4-ylethoxy)sulfamoyl]hexyl]-3-(pyridin-3-ylmethyl)urea
CID 46183166

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine?
The IUPAC name of 2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine (CID 161294474) is 2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine.
What is the SMILES notation for 2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine?
The canonical SMILES for 2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C#CCNC(C)(C)C.CC(C)(C)NC1CC2CCC1C2.CC(C)(C)NCCCCCC(=O)O.CC(C)(C)NCCCN1CCOCC1.CC(C)(C)NCCCn1ccnc1.CC(C)(C)NCCN1CCOCC1.CC(C)(C)NCCO.CC(C)(C)NCc1cccc(S(C)(=O)=O)c1.CC(C)(C)NCc1cccnc1.CC(C)(C)NN.CC(C)(C)N[C@H]1CCCC[C@@H]1N.CCNC(C)(C)C.CCOC(=O)c1ccc(CNC(C)(C)C)o1.CN(C)CCN(C)C(C)(C)C.COC(C)(C)C.
What is the InChIKey of 2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine?
The InChIKey is VGUFGZLRFHSVTQ-JGUPIDMPSA-N. The full InChI is InChI=1S/C12H19NO3.C12H19NO2S.C11H24N2O.C11H21N.C10H19N3.C10H22N2O.C10H16N2.C10H22N2.C10H21NO2.C9H22N2.C7H13N.C6H15NO.C6H15N.C5H12O.C4H12N2.14CH4/c1-5-15-11(14)10-7-6-9(16-10)8-13-12(2,3)4;1-12(2,3)13-9-10-6-5-7-11(8-10)16(4,14)15;1-11(2,3)12-5-4-6-13-7-9-14-10-8-13;1-11(2,3)12-10-7-8-4-5-9(10)6-8;1-10(2,3)12-5-4-7-13-8-6-11-9-13;1-10(2,3)11-4-5-12-6-8-13-9-7-12;1-10(2,3)12-8-9-5-4-6-11-7-9;1-10(2,3)12-9-7-5-4-6-8(9)11;1-10(2,3)11-8-6-4-5-7-9(12)13;1-9(2,3)11(6)8-7-10(4)5;1-5-6-8-7(2,3)4;1-6(2,3)7-4-5-8;1-5-7-6(2,3)4;1-5(2,3)6-4;1-4(2,3)6-5;;;;;;;;;;;;;;/h6-7,13H,5,8H2,1-4H3;5-8,13H,9H2,1-4H3;12H,4-10H2,1-3H3;8-10,12H,4-7H2,1-3H3;6,8-9,12H,4-5,7H2,1-3H3;11H,4-9H2,1-3H3;4-7,12H,8H2,1-3H3;8-9,12H,4-7,11H2,1-3H3;11H,4-8H2,1-3H3,(H,12,13);7-8H2,1-6H3;1,8H,6H2,2-4H3;7-8H,4-5H2,1-3H3;7H,5H2,1-4H3;1-4H3;6H,5H2,1-3H3;14*1H4/t;;;;;;;8-,9-;;;;;;;;;;;;;;;;;;;;;/m.......0...................../s1.
What are the key properties of 2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine?
2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine has a molecular weight of 2612.45 g/mol, XLogP of 30.62, 35 rotatable bonds, 17 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)ethanol;6-(tert-butylamino)hexanoic acid;N-tert-butylbicyclo[2.2.1]heptan-2-amine;tert-butylhydrazine;N'-tert-butyl-N,N,N'-trimethylethane-1,2-diamine;ethyl 5-[(tert-butylamino)methyl]furan-2-carboxylate;N-ethyl-2-methylpropan-2-amine;N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine;methane;2-methoxy-2-methylpropane;2-methyl-N-[(3-methylsulfonylphenyl)methyl]propan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine;2-methyl-N-(3-morpholin-4-ylpropyl)propan-2-amine;2-methyl-N-prop-2-ynylpropan-2-amine;2-methyl-N-(pyridin-3-ylmethyl)propan-2-amine;trans-(1S,2S)-2-N-tert-butylcyclohexane-1,2-diamine is sourced from PubChem (CID 161294474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).