About acetamide;1,1-difluoro-4-methylcyclohexane;N,N-dimethylacetamide;2,5-dimethyl-1,3,4-oxadiazole;bis(3,5-dimethyl-1,2-oxazole);1,4-dimethylpyrazole;3,5-dimethyl-1H-pyrazole;1,5-dimethylpyrrolidin-2-one;2,4-dimethyl-1,3-thiazole;1,4-dimethyltriazole;2,4-dimethyltriazole;3-ethyl-1,5-dimethylpyrazole;3-ethyl-5-methyl-1,2-oxazole;bis(5-ethyl-3-methyl-1,2-oxazole);3-ethyl-5-methyl-1H-pyrazole;N-methylacetamide;1-methylimidazole;3-methyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;(3S)-3-methylpyrrolidine-2,5-dione;1-methylpyrrolidin-2-one;5-methyl-2H-tetrazole;4-methyl-1,4-thiazinane 1,1-dioxide;4-methyl-2H-triazole;2-methyl-5-(trifluoromethyl)-1,3,4-oxadiazole;2,4,6-trimethyloxane;3,4,5-trimethyl-1,2-oxazole;bis(1,3,5-trimethylpyrazole);2,3,5-trimethyltetrazol-2-ium;2,4,5-trimethyl-1,3-thiazole
acetamide;1,1-difluoro-4-methylcyclohexane;N,N-dimethylacetamide;2,5-dimethyl-1,3,4-oxadiazole;bis(3,5-dimethyl-1,2-oxazole);1,4-dimethylpyrazole;3,5-dimethyl-1H-pyrazole;1,5-dimethylpyrrolidin-2-one;2,4-dimethyl-1,3-thiazole;1,4-dimethyltriazole;2,4-dimethyltriazole;3-ethyl-1,5-dimethylpyrazole;3-ethyl-5-methyl-1,2-oxazole;bis(5-ethyl-3-methyl-1,2-oxazole);3-ethyl-5-methyl-1H-pyrazole;N-methylacetamide;1-methylimidazole;3-methyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;(3S)-3-methylpyrrolidine-2,5-dione;1-methylpyrrolidin-2-one;5-methyl-2H-tetrazole;4-methyl-1,4-thiazinane 1,1-dioxide;4-methyl-2H-triazole;2-methyl-5-(trifluoromethyl)-1,3,4-oxadiazole;2,4,6-trimethyloxane;3,4,5-trimethyl-1,2-oxazole;bis(1,3,5-trimethylpyrazole);2,3,5-trimethyltetrazol-2-ium;2,4,5-trimethyl-1,3-thiazole (PubChem CID 158043696) has the molecular formula C183H305F5N55O25S3+
and a molecular weight of 3867.00 g/mol. Its IUPAC name is acetamide;1,1-difluoro-4-methylcyclohexane;N,N-dimethylacetamide;2,5-dimethyl-1,3,4-oxadiazole;bis(3,5-dimethyl-1,2-oxazole);1,4-dimethylpyrazole;3,5-dimethyl-1H-pyrazole;1,5-dimethylpyrrolidin-2-one;2,4-dimethyl-1,3-thiazole;1,4-dimethyltriazole;2,4-dimethyltriazole;3-ethyl-1,5-dimethylpyrazole;3-ethyl-5-methyl-1,2-oxazole;bis(5-ethyl-3-methyl-1,2-oxazole);3-ethyl-5-methyl-1H-pyrazole;N-methylacetamide;1-methylimidazole;3-methyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;(3S)-3-methylpyrrolidine-2,5-dione;1-methylpyrrolidin-2-one;5-methyl-2H-tetrazole;4-methyl-1,4-thiazinane 1,1-dioxide;4-methyl-2H-triazole;2-methyl-5-(trifluoromethyl)-1,3,4-oxadiazole;2,4,6-trimethyloxane;3,4,5-trimethyl-1,2-oxazole;bis(1,3,5-trimethylpyrazole);2,3,5-trimethyltetrazol-2-ium;2,4,5-trimethyl-1,3-thiazole.
Frequently Asked Questions
What is the IUPAC name of acetamide;1,1-difluoro-4-methylcyclohexane;N,N-dimethylacetamide;2,5-dimethyl-1,3,4-oxadiazole;bis(3,5-dimethyl-1,2-oxazole);1,4-dimethylpyrazole;3,5-dimethyl-1H-pyrazole;1,5-dimethylpyrrolidin-2-one;2,4-dimethyl-1,3-thiazole;1,4-dimethyltriazole;2,4-dimethyltriazole;3-ethyl-1,5-dimethylpyrazole;3-ethyl-5-methyl-1,2-oxazole;bis(5-ethyl-3-methyl-1,2-oxazole);3-ethyl-5-methyl-1H-pyrazole;N-methylacetamide;1-methylimidazole;3-methyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;(3S)-3-methylpyrrolidine-2,5-dione;1-methylpyrrolidin-2-one;5-methyl-2H-tetrazole;4-methyl-1,4-thiazinane 1,1-dioxide;4-methyl-2H-triazole;2-methyl-5-(trifluoromethyl)-1,3,4-oxadiazole;2,4,6-trimethyloxane;3,4,5-trimethyl-1,2-oxazole;bis(1,3,5-trimethylpyrazole);2,3,5-trimethyltetrazol-2-ium;2,4,5-trimethyl-1,3-thiazole?
The IUPAC name of acetamide;1,1-difluoro-4-methylcyclohexane;N,N-dimethylacetamide;2,5-dimethyl-1,3,4-oxadiazole;bis(3,5-dimethyl-1,2-oxazole);1,4-dimethylpyrazole;3,5-dimethyl-1H-pyrazole;1,5-dimethylpyrrolidin-2-one;2,4-dimethyl-1,3-thiazole;1,4-dimethyltriazole;2,4-dimethyltriazole;3-ethyl-1,5-dimethylpyrazole;3-ethyl-5-methyl-1,2-oxazole;bis(5-ethyl-3-methyl-1,2-oxazole);3-ethyl-5-methyl-1H-pyrazole;N-methylacetamide;1-methylimidazole;3-methyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;(3S)-3-methylpyrrolidine-2,5-dione;1-methylpyrrolidin-2-one;5-methyl-2H-tetrazole;4-methyl-1,4-thiazinane 1,1-dioxide;4-methyl-2H-triazole;2-methyl-5-(trifluoromethyl)-1,3,4-oxadiazole;2,4,6-trimethyloxane;3,4,5-trimethyl-1,2-oxazole;bis(1,3,5-trimethylpyrazole);2,3,5-trimethyltetrazol-2-ium;2,4,5-trimethyl-1,3-thiazole (CID 158043696) is acetamide;1,1-difluoro-4-methylcyclohexane;N,N-dimethylacetamide;2,5-dimethyl-1,3,4-oxadiazole;bis(3,5-dimethyl-1,2-oxazole);1,4-dimethylpyrazole;3,5-dimethyl-1H-pyrazole;1,5-dimethylpyrrolidin-2-one;2,4-dimethyl-1,3-thiazole;1,4-dimethyltriazole;2,4-dimethyltriazole;3-ethyl-1,5-dimethylpyrazole;3-ethyl-5-methyl-1,2-oxazole;bis(5-ethyl-3-methyl-1,2-oxazole);3-ethyl-5-methyl-1H-pyrazole;N-methylacetamide;1-methylimidazole;3-methyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;(3S)-3-methylpyrrolidine-2,5-dione;1-methylpyrrolidin-2-one;5-methyl-2H-tetrazole;4-methyl-1,4-thiazinane 1,1-dioxide;4-methyl-2H-triazole;2-methyl-5-(trifluoromethyl)-1,3,4-oxadiazole;2,4,6-trimethyloxane;3,4,5-trimethyl-1,2-oxazole;bis(1,3,5-trimethylpyrazole);2,3,5-trimethyltetrazol-2-ium;2,4,5-trimethyl-1,3-thiazole.
What is the SMILES notation for acetamide;1,1-difluoro-4-methylcyclohexane;N,N-dimethylacetamide;2,5-dimethyl-1,3,4-oxadiazole;bis(3,5-dimethyl-1,2-oxazole);1,4-dimethylpyrazole;3,5-dimethyl-1H-pyrazole;1,5-dimethylpyrrolidin-2-one;2,4-dimethyl-1,3-thiazole;1,4-dimethyltriazole;2,4-dimethyltriazole;3-ethyl-1,5-dimethylpyrazole;3-ethyl-5-methyl-1,2-oxazole;bis(5-ethyl-3-methyl-1,2-oxazole);3-ethyl-5-methyl-1H-pyrazole;N-methylacetamide;1-methylimidazole;3-methyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;(3S)-3-methylpyrrolidine-2,5-dione;1-methylpyrrolidin-2-one;5-methyl-2H-tetrazole;4-methyl-1,4-thiazinane 1,1-dioxide;4-methyl-2H-triazole;2-methyl-5-(trifluoromethyl)-1,3,4-oxadiazole;2,4,6-trimethyloxane;3,4,5-trimethyl-1,2-oxazole;bis(1,3,5-trimethylpyrazole);2,3,5-trimethyltetrazol-2-ium;2,4,5-trimethyl-1,3-thiazole?
The canonical SMILES for acetamide;1,1-difluoro-4-methylcyclohexane;N,N-dimethylacetamide;2,5-dimethyl-1,3,4-oxadiazole;bis(3,5-dimethyl-1,2-oxazole);1,4-dimethylpyrazole;3,5-dimethyl-1H-pyrazole;1,5-dimethylpyrrolidin-2-one;2,4-dimethyl-1,3-thiazole;1,4-dimethyltriazole;2,4-dimethyltriazole;3-ethyl-1,5-dimethylpyrazole;3-ethyl-5-methyl-1,2-oxazole;bis(5-ethyl-3-methyl-1,2-oxazole);3-ethyl-5-methyl-1H-pyrazole;N-methylacetamide;1-methylimidazole;3-methyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;(3S)-3-methylpyrrolidine-2,5-dione;1-methylpyrrolidin-2-one;5-methyl-2H-tetrazole;4-methyl-1,4-thiazinane 1,1-dioxide;4-methyl-2H-triazole;2-methyl-5-(trifluoromethyl)-1,3,4-oxadiazole;2,4,6-trimethyloxane;3,4,5-trimethyl-1,2-oxazole;bis(1,3,5-trimethylpyrazole);2,3,5-trimethyltetrazol-2-ium;2,4,5-trimethyl-1,3-thiazole is CC(=O)N(C)C.CC(N)=O.CC1CC(C)OC(C)C1.CC1CCC(=O)N1C.CC1CCC(F)(F)CC1.CCc1cc(C)[nH]n1.CCc1cc(C)n(C)n1.CCc1cc(C)no1.CCc1cc(C)no1.CCc1cc(C)on1.CN1CCCC1=O.CN1CCOC1=O.CN1CCS(=O)(=O)CC1.CNC(C)=O.C[C@@H]1CNC(=O)O1.C[C@H]1CC(=O)NC1=O.Cc1cc(C(C)C)no1.Cc1cc(C(C)C)on1.Cc1cc(C)[nH]n1.Cc1cc(C)n(C)n1.Cc1cc(C)n(C)n1.Cc1cc(C)on1.Cc1cc(C)on1.Cc1cn(C)nn1.Cc1cn[nH]n1.Cc1cnn(C)c1.Cc1cnn(C)n1.Cc1cnoc1C(C)C.Cc1csc(C)n1.Cc1nc(C)c(C)s1.Cc1nn(C)[n+](C)n1.Cc1nn[nH]n1.Cc1nnc(C(F)(F)F)o1.Cc1nnc(C)o1.Cc1noc(C)c1C.Cn1ccnc1.
What is the InChIKey of acetamide;1,1-difluoro-4-methylcyclohexane;N,N-dimethylacetamide;2,5-dimethyl-1,3,4-oxadiazole;bis(3,5-dimethyl-1,2-oxazole);1,4-dimethylpyrazole;3,5-dimethyl-1H-pyrazole;1,5-dimethylpyrrolidin-2-one;2,4-dimethyl-1,3-thiazole;1,4-dimethyltriazole;2,4-dimethyltriazole;3-ethyl-1,5-dimethylpyrazole;3-ethyl-5-methyl-1,2-oxazole;bis(5-ethyl-3-methyl-1,2-oxazole);3-ethyl-5-methyl-1H-pyrazole;N-methylacetamide;1-methylimidazole;3-methyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;(3S)-3-methylpyrrolidine-2,5-dione;1-methylpyrrolidin-2-one;5-methyl-2H-tetrazole;4-methyl-1,4-thiazinane 1,1-dioxide;4-methyl-2H-triazole;2-methyl-5-(trifluoromethyl)-1,3,4-oxadiazole;2,4,6-trimethyloxane;3,4,5-trimethyl-1,2-oxazole;bis(1,3,5-trimethylpyrazole);2,3,5-trimethyltetrazol-2-ium;2,4,5-trimethyl-1,3-thiazole?
The InChIKey is MMSSCLTZIKLNBJ-GSSVRCFFSA-N. The full InChI is InChI=1S/C8H16O.C7H12F2.C7H12N2.3C7H11NO.3C6H10N2.C6H11NO.4C6H9NO.C6H9NS.2C5H8N2.C5H11NO2S.C5H7NO2.2C5H7NO.C5H9NO.C5H7NS.C4H3F3N2O.C4H9N4.2C4H7N3.C4H6N2O.C4H6N2.2C4H7NO2.C4H9NO.C3H5N3.C3H7NO.C2H4N4.C2H5NO/c1-6-4-7(2)9-8(3)5-6;1-6-2-4-7(8,9)5-3-6;1-4-7-5-6(2)9(3)8-7;1-5(2)7-6(3)4-8-9-7;1-5(2)7-4-6(3)9-8-7;1-5(2)7-4-6(3)8-9-7;2*1-5-4-6(2)8(3)7-5;1-3-6-4-5(2)7-8-6;1-5-3-4-6(8)7(5)2;1-4-5(2)7-8-6(4)3;1-3-6-4-5(2)8-7-6;2*1-3-6-4-5(2)7-8-6;1-4-5(2)8-6(3)7-4;1-5-3-6-7(2)4-5;1-4-3-5(2)7-6-4;1-6-2-4-9(7,8)5-3-6;1-3-2-4(7)6-5(3)8;2*1-4-3-5(2)7-6-4;1-6-4-2-3-5(6)7;1-4-3-7-5(2)6-4;1-2-8-9-3(10-2)4(5,6)7;1-4-5-7(2)8(3)6-4;1-4-3-7(2)6-5-4;1-4-3-5-7(2)6-4;1-3-5-6-4(2)7-3;1-6-3-2-5-4-6;1-5-2-3-7-4(5)6;1-3-2-5-4(6)7-3;1-4(6)5(2)3;1-3-2-4-6-5-3;1-3(5)4-2;1-2-3-5-6-4-2;1-2(3)4/h6-8H,4-5H2,1-3H3;6H,2-5H2,1H3;5H,4H2,1-3H3;3*4-5H,1-3H3;2*4H,1-3H3;4H,3H2,1-2H3,(H,7,8);5H,3-4H2,1-2H3;1-3H3;3*4H,3H2,1-2H3;1-3H3;3-4H,1-2H3;3H,1-2H3,(H,6,7);2-5H2,1H3;3H,2H2,1H3,(H,6,7,8);2*3H,1-2H3;2-4H2,1H3;3H,1-2H3;1H3;1-3H3;2*3H,1-2H3;1-2H3;2-4H,1H3;2-3H2,1H3;3H,2H2,1H3,(H,5,6);1-3H3;2H,1H3,(H,4,5,6);1-2H3,(H,4,5);1H3,(H,3,4,5,6);1H3,(H2,3,4)/q;;;;;;;;;;;;;;;;;;;;;;;;+1;;;;;;;;;;;/t;;;;;;;;;;;;;;;;;;3-;;;;;;;;;;;;3-;;;;;/m..................0...........1...../s1.
What are the key properties of acetamide;1,1-difluoro-4-methylcyclohexane;N,N-dimethylacetamide;2,5-dimethyl-1,3,4-oxadiazole;bis(3,5-dimethyl-1,2-oxazole);1,4-dimethylpyrazole;3,5-dimethyl-1H-pyrazole;1,5-dimethylpyrrolidin-2-one;2,4-dimethyl-1,3-thiazole;1,4-dimethyltriazole;2,4-dimethyltriazole;3-ethyl-1,5-dimethylpyrazole;3-ethyl-5-methyl-1,2-oxazole;bis(5-ethyl-3-methyl-1,2-oxazole);3-ethyl-5-methyl-1H-pyrazole;N-methylacetamide;1-methylimidazole;3-methyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;(3S)-3-methylpyrrolidine-2,5-dione;1-methylpyrrolidin-2-one;5-methyl-2H-tetrazole;4-methyl-1,4-thiazinane 1,1-dioxide;4-methyl-2H-triazole;2-methyl-5-(trifluoromethyl)-1,3,4-oxadiazole;2,4,6-trimethyloxane;3,4,5-trimethyl-1,2-oxazole;bis(1,3,5-trimethylpyrazole);2,3,5-trimethyltetrazol-2-ium;2,4,5-trimethyl-1,3-thiazole?
acetamide;1,1-difluoro-4-methylcyclohexane;N,N-dimethylacetamide;2,5-dimethyl-1,3,4-oxadiazole;bis(3,5-dimethyl-1,2-oxazole);1,4-dimethylpyrazole;3,5-dimethyl-1H-pyrazole;1,5-dimethylpyrrolidin-2-one;2,4-dimethyl-1,3-thiazole;1,4-dimethyltriazole;2,4-dimethyltriazole;3-ethyl-1,5-dimethylpyrazole;3-ethyl-5-methyl-1,2-oxazole;bis(5-ethyl-3-methyl-1,2-oxazole);3-ethyl-5-methyl-1H-pyrazole;N-methylacetamide;1-methylimidazole;3-methyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;(3S)-3-methylpyrrolidine-2,5-dione;1-methylpyrrolidin-2-one;5-methyl-2H-tetrazole;4-methyl-1,4-thiazinane 1,1-dioxide;4-methyl-2H-triazole;2-methyl-5-(trifluoromethyl)-1,3,4-oxadiazole;2,4,6-trimethyloxane;3,4,5-trimethyl-1,2-oxazole;bis(1,3,5-trimethylpyrazole);2,3,5-trimethyltetrazol-2-ium;2,4,5-trimethyl-1,3-thiazole has a molecular weight of 3867.00 g/mol, XLogP of 31.13, 8 rotatable bonds, 8 hydrogen bond donors, and 69 hydrogen bond acceptors.
Where does this data come from?
All data for acetamide;1,1-difluoro-4-methylcyclohexane;N,N-dimethylacetamide;2,5-dimethyl-1,3,4-oxadiazole;bis(3,5-dimethyl-1,2-oxazole);1,4-dimethylpyrazole;3,5-dimethyl-1H-pyrazole;1,5-dimethylpyrrolidin-2-one;2,4-dimethyl-1,3-thiazole;1,4-dimethyltriazole;2,4-dimethyltriazole;3-ethyl-1,5-dimethylpyrazole;3-ethyl-5-methyl-1,2-oxazole;bis(5-ethyl-3-methyl-1,2-oxazole);3-ethyl-5-methyl-1H-pyrazole;N-methylacetamide;1-methylimidazole;3-methyl-1,3-oxazolidin-2-one;(5R)-5-methyl-1,3-oxazolidin-2-one;3-methyl-5-propan-2-yl-1,2-oxazole;4-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;(3S)-3-methylpyrrolidine-2,5-dione;1-methylpyrrolidin-2-one;5-methyl-2H-tetrazole;4-methyl-1,4-thiazinane 1,1-dioxide;4-methyl-2H-triazole;2-methyl-5-(trifluoromethyl)-1,3,4-oxadiazole;2,4,6-trimethyloxane;3,4,5-trimethyl-1,2-oxazole;bis(1,3,5-trimethylpyrazole);2,3,5-trimethyltetrazol-2-ium;2,4,5-trimethyl-1,3-thiazole is sourced from PubChem (CID 158043696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).