ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine

C139H270N46O3S — CID 159033296

IUPACethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine
SMILESCC.CCN(C)C1=NCCC1.CCN(C)C1=NCCN1.CCN(C)C1=NCCN1C.CCN(C)C1=NCCO1.CCN1C=NCC1.CCN1CCC=N1.CCN1CCCC1.CCN1CCCCC1.CCN1CCN(C)CC1.CCN1CCN=C1N.CCN1CCOCC1.CCn1cccc1.CCn1cccn1.CCn1ccnc1.CCn1cncn1.[H]/N=C(/C1CC1)N(C)CC.[H]/N=C(/c1ccccc1)N(C)CC.[H]/N=C(/c1cccs1)N(C)CC.[H]/N=C(/c1ccncc1)N(C)CC.[H]/N=C(\C)N(C)CC.[H]/N=C(\N(C)C)N(C)CC.[H]/N=C1\OCCN1CC
InChIInChI=1S/C10H14N2.C9H13N3.C8H12N2S.C7H15N3.C7H16N2.2C7H14N2.C7H15N.C6H13N3.C6H15N3.C6H12N2O.C6H13NO.C6H13N.C6H9N.C5H11N3.C5H10N2O.C5H10N2.C5H8N2.C5H10N2.C5H8N2.C5H12N2.C4H7N3.C2H6/c1-3-12(2)10(11)9-7-5-4-6-8-9;1-3-12(2)9(10)8-4-6-11-7-5-8;1-3-10(2)8(9)7-5-4-6-11-7;1-4-9(2)7-8-5-6-10(7)3;1-3-9-6-4-8(2)5-7-9;1-3-9(2)7-5-4-6-8-7;1-3-9(2)7(8)6-4-5-6;1-2-8-6-4-3-5-7-8;1-3-9(2)6-7-4-5-8-6;1-5-9(4)6(7)8(2)3;1-3-8(2)6-7-4-5-9-6;1-2-7-3-5-8-6-4-7;2*1-2-7-5-3-4-6-7;1-2-8-4-3-7-5(8)6;1-2-7-3-4-8-5(7)6;2*1-2-7-4-3-6-5-7;2*1-2-7-5-3-4-6-7;1-4-7(3)5(2)6;1-2-7-4-5-3-6-7;1-2/h4-8,11H,3H2,1-2H3;4-7,10H,3H2,1-2H3;4-6,9H,3H2,1-2H3;4-6H2,1-3H3;3-7H2,1-2H3;3-6H2,1-2H3;6,8H,3-5H2,1-2H3;2-7H2,1H3;3-5H2,1-2H3,(H,7,8);7H,5H2,1-4H3;3-5H2,1-2H3;2-6H2,1H3;2-6H2,1H3;3-6H,2H2,1H3;2-4H2,1H3,(H2,6,7);6H,2-4H2,1H3;5H,2-4H2,1H3;3-5H,2H2,1H3;4H,2-3,5H2,1H3;3-5H,2H2,1H3;6H,4H2,1-3H3;3-4H,2H2,1H3;1-2H3/b11-10-;10-9-;9-8-;;;;8-7-;;;7-6+;;;;;;6-5-;;;;;6-5+;;
InChIKeyJVDNMWHDIXKNBR-RNNHDVHNSA-N
MW2666.07 g/mol
LogP18.42
Rot. Bonds26

About ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine

ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine (PubChem CID 159033296) has the molecular formula C139H270N46O3S and a molecular weight of 2666.07 g/mol. Its IUPAC name is ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine.

Molecular Properties

Compound Nameethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine
PubChem CID159033296
Molecular FormulaC139H270N46O3S
Molecular Weight2666.07 g/mol
Exact Mass2664.21
IUPAC Nameethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine
SMILESCC.CCN(C)C1=NCCC1.CCN(C)C1=NCCN1.CCN(C)C1=NCCN1C.CCN(C)C1=NCCO1.CCN1C=NCC1.CCN1CCC=N1.CCN1CCCC1.CCN1CCCCC1.CCN1CCN(C)CC1.CCN1CCN=C1N.CCN1CCOCC1.CCn1cccc1.CCn1cccn1.CCn1ccnc1.CCn1cncn1.[H]/N=C(/C1CC1)N(C)CC.[H]/N=C(/c1ccccc1)N(C)CC.[H]/N=C(/c1cccs1)N(C)CC.[H]/N=C(/c1ccncc1)N(C)CC.[H]/N=C(\C)N(C)CC.[H]/N=C(\N(C)C)N(C)CC.[H]/N=C1\OCCN1CC
InChIInChI=1S/C10H14N2.C9H13N3.C8H12N2S.C7H15N3.C7H16N2.2C7H14N2.C7H15N.C6H13N3.C6H15N3.C6H12N2O.C6H13NO.C6H13N.C6H9N.C5H11N3.C5H10N2O.C5H10N2.C5H8N2.C5H10N2.C5H8N2.C5H12N2.C4H7N3.C2H6/c1-3-12(2)10(11)9-7-5-4-6-8-9;1-3-12(2)9(10)8-4-6-11-7-5-8;1-3-10(2)8(9)7-5-4-6-11-7;1-4-9(2)7-8-5-6-10(7)3;1-3-9-6-4-8(2)5-7-9;1-3-9(2)7-5-4-6-8-7;1-3-9(2)7(8)6-4-5-6;1-2-8-6-4-3-5-7-8;1-3-9(2)6-7-4-5-8-6;1-5-9(4)6(7)8(2)3;1-3-8(2)6-7-4-5-9-6;1-2-7-3-5-8-6-4-7;2*1-2-7-5-3-4-6-7;1-2-8-4-3-7-5(8)6;1-2-7-3-4-8-5(7)6;2*1-2-7-4-3-6-5-7;2*1-2-7-5-3-4-6-7;1-4-7(3)5(2)6;1-2-7-4-5-3-6-7;1-2/h4-8,11H,3H2,1-2H3;4-7,10H,3H2,1-2H3;4-6,9H,3H2,1-2H3;4-6H2,1-3H3;3-7H2,1-2H3;3-6H2,1-2H3;6,8H,3-5H2,1-2H3;2-7H2,1H3;3-5H2,1-2H3,(H,7,8);7H,5H2,1-4H3;3-5H2,1-2H3;2-6H2,1H3;2-6H2,1H3;3-6H,2H2,1H3;2-4H2,1H3,(H2,6,7);6H,2-4H2,1H3;5H,2-4H2,1H3;3-5H,2H2,1H3;4H,2-3,5H2,1H3;3-5H,2H2,1H3;6H,4H2,1-3H3;3-4H,2H2,1H3;1-2H3/b11-10-;10-9-;9-8-;;;;8-7-;;;7-6+;;;;;;6-5-;;;;;6-5+;;
InChIKeyJVDNMWHDIXKNBR-RNNHDVHNSA-N
XLogP18.42
TPSA471.42 Ų
H-Bond Donors9
H-Bond Acceptors42
Rotatable Bonds26
Heavy Atoms189
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002666.07
LogP ≤ 518.42
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1042

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine with MolForge

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Related Compounds

1-(cyclopropylmethyl)-4-propan-2-ylpyrazole;1-cyclopropyl-4-propan-2-ylpyrazole;1,3-dimethyl-4-propan-2-ylpyrazole;1,5-dimethyl-4-propan-2-ylpyrazole;1,4-di(propan-2-yl)pyrazole;1-(1-ethoxy-2,2,2-trifluoroethyl)-4-propan-2-ylpyrazole;bis(1-ethyl-4-propan-2-ylpyrazole);1-(2-methoxyethyl)-4-propan-2-ylpyrazole;1-[(4-methylphenyl)methyl]-4-propan-2-ylpyrazole;2-methyl-5-propan-2-ylpyrazine;bis(1-methyl-4-propan-2-ylpyrazole);5-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylpyrazine;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylthiophene
CID 159127075
2-(3H-furan-3-id-2-yl)pyrimidine;4-[(E)-2-(5-hexylthiophen-2-yl)ethenyl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;5-(5-hexylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-(5-methyl-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl)pyridine;2-[5-(2,3,4,5-tetrafluorophenyl)pyrazol-1-id-3-yl]pyridine;2-(3H-thiophen-3-id-2-yl)pyrimidine;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyrazine;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyrimidine;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-1,3,5-triazine
CID 159442323
1-Benzyl-4-methylpiperazine;1,4-dimethylpiperazine;1-methylimidazole;4-methylmorpholine;1-methylpiperazine;1-methylpiperidine;1-methylpyrazole;1-methylpyrrole;1-methylpyrrolidine;1-methyltriazole;1-methyl-1,2,4-triazole
CID 157135503
azetidine;benzene;ethane;methane;undecakis(2-methylpropane);1-methyl-4-propan-2-ylpiperazine;1-methylpyrazole;1-methyltriazole;1-methyl-1,2,4-triazole;1-propan-2-ylazetidine;propan-2-ylcyclopropane;1-propan-2-ylimidazole;4-propan-2-ylmorpholine;bis(1-propan-2-ylpyrazole);1-propan-2-ylpyrrolidine;5-propan-2-yl-5H-tetrazole;pyridine;pyrimidine;pyrrolidine;1,3,4-thiadiazole;1,3-thiazole;thiophene
CID 157433179
azetidine;benzene;ethane;undecakis(2-methylpropane);1-methyl-4-propan-2-ylpiperazine;1-methylpyrazole;1-methyltriazole;1-methyl-1,2,4-triazole;1-propan-2-ylazetidine;propan-2-ylcyclopropane;1-propan-2-ylimidazole;4-propan-2-ylmorpholine;bis(1-propan-2-ylpyrazole);1-propan-2-ylpyrrolidine;5-propan-2-yl-5H-tetrazole;pyridine;pyrimidine;pyrrolidine;1,3,4-thiadiazole;1,3-thiazole;thiophene
CID 158218147
1-cyano-2-ethylguanidine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;2-ethyl-1,1-dimethylguanidine;2-ethylguanidine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-1-methylguanidine;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine
CID 158472178
benzene;ethane;1H-imidazole;nonakis(2-methylpropane);4-methyl-5-propan-2-yl-2H-triazole;5-methyl-3-propan-2-yl-1H-1,2,4-triazole;1-propan-2-ylpyrazole;pyrazine;1H-pyrazole;pyridazine;pyridine;pyrimidine;thiophene;1,2,4-triazine
CID 158900124
1-Benzylpiperidine;dodecakis(2-methylpropane);4-phenylmorpholine;1-phenylpiperazine;1-phenylpiperidine;2-phenylpyridine;3-phenylpyridine;4-phenylpyridine;3-(piperidin-1-ylmethyl)-1,2-thiazole;1-(3-propan-2-yl-5-pyrazol-1-ylphenyl)pyrazole;2-pyridin-3-ylpyrimidine;2-(3-pyrimidin-2-ylphenyl)pyrimidine;2-[3-(1,2,4-triazol-1-yl)phenyl]pyrimidine;2-[3-(triazol-2-yl)phenyl]pyrimidine
CID 159301270
Azetidine;benzene;ethane;octakis(2-methylpropane);1-methyl-4-propan-2-ylpiperazine;1-methylpyrazole;1-propan-2-ylazetidine;propan-2-ylcyclopropane;1-propan-2-ylimidazole;4-propan-2-ylmorpholine;1-propan-2-ylpyrazole;1-propan-2-ylpyrrolidine;pyridine;pyrimidine;pyrrolidine;1,3-thiazole;thiophene
CID 159401240
3,7-Dimethylimidazo[1,2-a]pyrimidine;3,7-dimethylimidazo[1,2-b][1,2,4]triazine;1,6-dimethylpyrazolo[4,5-c]pyridine;2,4-dimethylpyridine;2,6-dimethylpyridine;2,3-dimethylthiophene;7-methyl-2-methylidene-1,3-dihydroimidazo[4,5-c]pyridine;2,3,5-trimethylpyridine;2,3,6-trimethylpyridine
CID 159841265
butan-2-one;2,5-dimethyltetrazole;3,4-dimethyl-1,2,4-triazole;ethane;1-methylimidazole;piperidine;pyrazine;pyridazine;pyridine;pyrimidine;thiophene;toluene;2H-triazole;2,4,6-trimethyl-1,3,5-triazine
CID 160070499
butanimidamide;1-cyano-2-ethylguanidine;1-cyclopropylbutan-1-imine;ethane;N'-ethylethanimidamide;2-ethylguanidine;1-ethylimidazole;4-ethylmorpholine;bis(1-ethylpiperidine);1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-[4-(4-fluorophenyl)piperazin-1-yl]ethanimine;bis(pentan-2-imine);1-phenylbutan-1-imine;1-(4-phenylpiperazin-1-yl)ethanimine;2-propyl-4,5-dihydro-1H-imidazole;2-propyl-4,5-dihydro-1,3-oxazole;bis(5-propyl-3,4-dihydro-2H-pyrrole);1-pyridin-4-ylbutan-1-imine;1-thiophen-2-ylbutan-1-imine
CID 160273360

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine?
The IUPAC name of ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine (CID 159033296) is ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine.
What is the SMILES notation for ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine?
The canonical SMILES for ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine is CC.CCN(C)C1=NCCC1.CCN(C)C1=NCCN1.CCN(C)C1=NCCN1C.CCN(C)C1=NCCO1.CCN1C=NCC1.CCN1CCC=N1.CCN1CCCC1.CCN1CCCCC1.CCN1CCN(C)CC1.CCN1CCN=C1N.CCN1CCOCC1.CCn1cccc1.CCn1cccn1.CCn1ccnc1.CCn1cncn1.[H]/N=C(/C1CC1)N(C)CC.[H]/N=C(/c1ccccc1)N(C)CC.[H]/N=C(/c1cccs1)N(C)CC.[H]/N=C(/c1ccncc1)N(C)CC.[H]/N=C(\C)N(C)CC.[H]/N=C(\N(C)C)N(C)CC.[H]/N=C1\OCCN1CC.
What is the InChIKey of ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine?
The InChIKey is JVDNMWHDIXKNBR-RNNHDVHNSA-N. The full InChI is InChI=1S/C10H14N2.C9H13N3.C8H12N2S.C7H15N3.C7H16N2.2C7H14N2.C7H15N.C6H13N3.C6H15N3.C6H12N2O.C6H13NO.C6H13N.C6H9N.C5H11N3.C5H10N2O.C5H10N2.C5H8N2.C5H10N2.C5H8N2.C5H12N2.C4H7N3.C2H6/c1-3-12(2)10(11)9-7-5-4-6-8-9;1-3-12(2)9(10)8-4-6-11-7-5-8;1-3-10(2)8(9)7-5-4-6-11-7;1-4-9(2)7-8-5-6-10(7)3;1-3-9-6-4-8(2)5-7-9;1-3-9(2)7-5-4-6-8-7;1-3-9(2)7(8)6-4-5-6;1-2-8-6-4-3-5-7-8;1-3-9(2)6-7-4-5-8-6;1-5-9(4)6(7)8(2)3;1-3-8(2)6-7-4-5-9-6;1-2-7-3-5-8-6-4-7;2*1-2-7-5-3-4-6-7;1-2-8-4-3-7-5(8)6;1-2-7-3-4-8-5(7)6;2*1-2-7-4-3-6-5-7;2*1-2-7-5-3-4-6-7;1-4-7(3)5(2)6;1-2-7-4-5-3-6-7;1-2/h4-8,11H,3H2,1-2H3;4-7,10H,3H2,1-2H3;4-6,9H,3H2,1-2H3;4-6H2,1-3H3;3-7H2,1-2H3;3-6H2,1-2H3;6,8H,3-5H2,1-2H3;2-7H2,1H3;3-5H2,1-2H3,(H,7,8);7H,5H2,1-4H3;3-5H2,1-2H3;2-6H2,1H3;2-6H2,1H3;3-6H,2H2,1H3;2-4H2,1H3,(H2,6,7);6H,2-4H2,1H3;5H,2-4H2,1H3;3-5H,2H2,1H3;4H,2-3,5H2,1H3;3-5H,2H2,1H3;6H,4H2,1-3H3;3-4H,2H2,1H3;1-2H3/b11-10-;10-9-;9-8-;;;;8-7-;;;7-6+;;;;;;6-5-;;;;;6-5+;;.
What are the key properties of ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine?
ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine has a molecular weight of 2666.07 g/mol, XLogP of 18.42, 26 rotatable bonds, 9 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;N-ethyl-N,1-dimethyl-4,5-dihydroimidazol-2-amine;1-ethylimidazole;N-ethyl-N-methylbenzenecarboximidamide;N-ethyl-N-methylcyclopropanecarboximidamide;N-ethyl-N-methyl-4,5-dihydro-1H-imidazol-2-amine;N-ethyl-N-methyl-4,5-dihydro-1,3-oxazol-2-amine;N-ethyl-N-methyl-3,4-dihydro-2H-pyrrol-5-amine;N-ethyl-N-methylethanimidamide;1-ethyl-4-methylpiperazine;N-ethyl-N-methylpyridine-4-carboximidamide;N-ethyl-N-methylthiophene-2-carboximidamide;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethyl-1,2,4-triazole;1-ethyl-1,3,3-trimethylguanidine is sourced from PubChem (CID 159033296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).