1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone

C115H136F3N23O30 — CID 159195077

IUPAC1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone
SMILESCC(=O)C1=CC(C)=NC1.CC(=O)C1=CC=CC1.CC(=O)C1=NC=CC1.CC(=O)c1cc(C)[nH]n1.CC(=O)c1cc(C)on1.CC(=O)c1cccn1C.CC(=O)c1ccco1.CC(=O)c1ccnn1C.CC(=O)c1ccnn1C.CC(=O)c1ccno1.CC(=O)c1cnc(N)o1.CC(=O)c1cnc[nH]1.CC(=O)c1cnco1.CC(=O)c1cocn1.CC(=O)c1nc(C)oc1C.CC(=O)c1nc(C)oc1C(F)(F)F.CC(=O)c1oc(C)nc1C.CC(=O)c1oc(N)nc1C.CC(=O)c1ocnc1C
InChIInChI=1S/C7H6F3NO2.2C7H9NO2.2C7H9NO.C7H8O.C6H8N2O2.3C6H8N2O.2C6H7NO2.C6H7NO.C6H6O2.C5H6N2O2.C5H6N2O.3C5H5NO2/c1-3(12)5-6(7(8,9)10)13-4(2)11-5;1-4(9)7-5(2)10-6(3)8-7;1-4-7(5(2)9)10-6(3)8-4;1-5-3-7(4-8-5)6(2)9;1-6(9)7-4-3-5-8(7)2;1-6(8)7-4-2-3-5-7;1-3-5(4(2)9)10-6(7)8-3;2*1-5(9)6-3-4-7-8(6)2;1-4-3-6(5(2)9)8-7-4;1-4-6(5(2)8)9-3-7-4;1-4-3-6(5(2)8)7-9-4;1-5(8)6-3-2-4-7-6;1-5(7)6-3-2-4-8-6;1-3(8)4-2-7-5(6)9-4;1-4(8)5-2-6-3-7-5;1-4(7)5-2-8-3-6-5;1-4(7)5-2-6-3-8-5;1-4(7)5-2-3-6-8-5/h1-2H3;2*1-3H3;3H,4H2,1-2H3;3-5H,1-2H3;2-4H,5H2,1H3;1-2H3,(H2,7,8);2*3-4H,1-2H3;3H,1-2H3,(H,7,8);2*3H,1-2H3;2,4H,3H2,1H3;2-4H,1H3;2H,1H3,(H2,6,7);2-3H,1H3,(H,6,7);3*2-3H,1H3
InChIKeyKOOHDSYBGMSAGU-UHFFFAOYSA-N
MW2377.48 g/mol
LogP20.28
Rot. Bonds19

About 1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone

1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone (PubChem CID 159195077) has the molecular formula C115H136F3N23O30 and a molecular weight of 2377.48 g/mol. Its IUPAC name is 1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone.

Molecular Properties

Compound Name1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone
PubChem CID159195077
Molecular FormulaC115H136F3N23O30
Molecular Weight2377.48 g/mol
Exact Mass2375.98
IUPAC Name1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone
SMILESCC(=O)C1=CC(C)=NC1.CC(=O)C1=CC=CC1.CC(=O)C1=NC=CC1.CC(=O)c1cc(C)[nH]n1.CC(=O)c1cc(C)on1.CC(=O)c1cccn1C.CC(=O)c1ccco1.CC(=O)c1ccnn1C.CC(=O)c1ccnn1C.CC(=O)c1ccno1.CC(=O)c1cnc(N)o1.CC(=O)c1cnc[nH]1.CC(=O)c1cnco1.CC(=O)c1cocn1.CC(=O)c1nc(C)oc1C.CC(=O)c1nc(C)oc1C(F)(F)F.CC(=O)c1oc(C)nc1C.CC(=O)c1oc(N)nc1C.CC(=O)c1ocnc1C
InChIInChI=1S/C7H6F3NO2.2C7H9NO2.2C7H9NO.C7H8O.C6H8N2O2.3C6H8N2O.2C6H7NO2.C6H7NO.C6H6O2.C5H6N2O2.C5H6N2O.3C5H5NO2/c1-3(12)5-6(7(8,9)10)13-4(2)11-5;1-4(9)7-5(2)10-6(3)8-7;1-4-7(5(2)9)10-6(3)8-4;1-5-3-7(4-8-5)6(2)9;1-6(9)7-4-3-5-8(7)2;1-6(8)7-4-2-3-5-7;1-3-5(4(2)9)10-6(7)8-3;2*1-5(9)6-3-4-7-8(6)2;1-4-3-6(5(2)9)8-7-4;1-4-6(5(2)8)9-3-7-4;1-4-3-6(5(2)8)7-9-4;1-5(8)6-3-2-4-7-6;1-5(7)6-3-2-4-8-6;1-3(8)4-2-7-5(6)9-4;1-4(8)5-2-6-3-7-5;1-4(7)5-2-8-3-6-5;1-4(7)5-2-6-3-8-5;1-4(7)5-2-3-6-8-5/h1-2H3;2*1-3H3;3H,4H2,1-2H3;3-5H,1-2H3;2-4H,5H2,1H3;1-2H3,(H2,7,8);2*3-4H,1-2H3;3H,1-2H3,(H,7,8);2*3H,1-2H3;2,4H,3H2,1H3;2-4H,1H3;2H,1H3,(H2,6,7);2-3H,1H3,(H,6,7);3*2-3H,1H3
InChIKeyKOOHDSYBGMSAGU-UHFFFAOYSA-N
XLogP20.28
TPSA772.46 Ų
H-Bond Donors4
H-Bond Acceptors51
Rotatable Bonds19
Heavy Atoms171
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002377.48
LogP ≤ 520.28
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1051

Analyze 1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone with MolForge

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Launch Full Analysis

Related Compounds

5-acetylfuran-2-carbonitrile;1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-(5-bromofuran-2-yl)ethanone;1-(5-chlorofuran-2-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(5-fluorofuran-2-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(5-methylfuran-2-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone
CID 157240681
1-tert-butylcyclopenta-1,3-diene;2-tert-butylcyclopenta-1,3-diene;5-tert-butyl-4,5-dihydro-1H-imidazole;5-tert-butyl-3,4-dihydro-2H-pyrrole;2-tert-butylfuran;1-tert-butylimidazole;2-tert-butyl-1H-imidazole;2-tert-butyl-4H-imidazole;5-tert-butyl-1,2,4-oxadiazole;bis(2-tert-butyl-1,3-oxazole);1-tert-butylpyrazole;3-tert-butyl-4H-pyrazole;5-tert-butyl-1H-pyrazole;5-tert-butyl-3H-pyrazole;2-tert-butyl-3H-pyrrole;4-tert-butyl-2H-pyrrole;4-tert-butyl-3H-pyrrole;bis(5-tert-butyl-3H-pyrrole);1-tert-butyl-1,2,4-triazole;methane
CID 157106927
2-tert-butylcyclopenta-1,3-diene;2-tert-butyl-4,5-dihydro-1H-imidazole;5-tert-butyl-4,5-dihydro-1H-imidazole;2-tert-butylfuran;1-tert-butylimidazole;bis(2-tert-butyl-1H-imidazole);2-tert-butyl-4H-imidazole;5-tert-butyl-1H-imidazole;5-tert-butyl-1,2,4-oxadiazole;bis(2-tert-butyl-1,3-oxazole);4-tert-butyl-1,3-oxazole;1-tert-butylpyrazole;5-tert-butyl-1H-pyrazole;5-tert-butyl-3H-pyrazole;2-tert-butyl-1H-pyrrole;4-tert-butyl-2H-pyrrole;5-tert-butyl-3H-pyrrole;1-tert-butyltriazole;5-tert-butyl-1H-1,2,4-triazole;methane
CID 157271473
1-(1,3-dimethylpyrazol-4-yl)-2-methylpropan-1-one;1-(4-fluorophenyl)-3-methylbutan-2-one;1-[1-(2-hydroxyethyl)pyrazol-4-yl]-2-methylpropan-1-one;1-(1H-imidazol-5-yl)-2-methylpropan-1-one;2-methyl-1-(1-methylimidazol-4-yl)propan-1-one;2-methyl-1-(3-methyl-1,2-oxazol-5-yl)propan-1-one;2-methyl-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one;2-methyl-1-(5-methyl-1,2-oxazol-3-yl)propan-1-one;2-methyl-1-(5-methyl-1,2-oxazol-4-yl)propan-1-one;2-methyl-1-(1-methylpyrazol-4-yl)propan-1-one;2-methyl-1-(5-methyl-1H-pyrazol-4-yl)propan-1-one;3-methyl-1-(6-methyl-3-pyridinyl)butan-2-one;2-methyl-1-(5-methyl-2H-pyrrol-3-yl)propan-1-one;2-methyl-1-(1,2-oxazol-4-yl)propan-1-one;2-methyl-1-(1,3-oxazol-5-yl)propan-1-one;2-methyl-1-(1H-pyrazol-4-yl)propan-1-one
CID 157310034
bis(2,4-bis(2,2-dimethylpropyl)furan);2,5-bis(2,2-dimethylpropyl)furan;2,5-bis(2,2-dimethylpropyl)-1H-imidazole;bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);1,3-bis(2,2-dimethylpropyl)pyrazole;3,5-bis(2,2-dimethylpropyl)-1H-pyrazole;2,4-bis(2,2-dimethylpropyl)-3H-pyrrole;1,3-bis(2,2-dimethylpropyl)-1,2,4-triazole;1,4-bis(2,2-dimethylpropyl)triazole;2,4-bis(2,2-dimethylpropyl)triazole;3,5-bis(2,2-dimethylpropyl)-1H-1,2,4-triazole
CID 158153375
bis(2,3-dimethylfuran);bis(2,4-dimethylfuran);2,5-dimethylfuran;3,4-dimethylfuran;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3,4-oxadiazole;3,4-dimethyl-1,2,5-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;2,4-dimethyl-1,3-oxazole;2,5-dimethyl-1,3-oxazole;3,4-dimethyl-1,2-oxazole;bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(1,4-dimethylpyrazole);bis(1,5-dimethylpyrazole);bis(3,5-dimethyl-1H-pyrazole);tris(4,5-dimethyl-1H-pyrazole);2,5-dimethyltetrazole;1,5-dimethyl-2H-tetrazol-1-ium;1,3-dimethyl-1,2,4-triazole;1,4-dimethyltriazole;1,5-dimethyltriazole;1,5-dimethyl-1,2,4-triazole;3,4-dimethyl-1,2,4-triazole
CID 158267241
2,5-dimethyl-3-propan-2-yl-1H-pyrazol-2-ium;1-methyl-2-propan-2-ylimidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;1-methyl-2-propan-2-ylpyrrole;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1H-pyrazole
CID 159108525
3,5-dimethyl-4-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-ylfuran;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;bis(1-methyl-2-propan-2-ylpyrrole);2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;2-propan-2-yl-1H-pyrrole
CID 159568907
3,4-ditert-butyl-2,5-dihydrofuran;bis(4,5-ditert-butyl-2,3-dihydrofuran);bis(2,3-ditert-butylfuran);3,4-ditert-butylfuran;4,5-ditert-butyl-1H-imidazole;bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,3-oxazole);4,5-ditert-butyl-1H-pyrazole;bis(4,5-ditert-butyl-2H-triazole);ethane
CID 160762824
1,3-dimethyl-5-propan-2-ylpyrazole;methane;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-2-propan-2-ylpyrrole;2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1H-pyrrole
CID 160860509
3,4-ditert-butyl-2,5-dihydrofuran;bis(4,5-ditert-butyl-2,3-dihydrofuran);bis(2,3-ditert-butylfuran);bis(3,4-ditert-butylfuran);bis(4,5-ditert-butyl-1H-imidazole);3,4-ditert-butyl-1,2-oxazole;bis(4,5-ditert-butyl-1,2-oxazole);4,5-ditert-butyl-1,3-oxazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);bis(2,3-ditert-butyl-1H-pyrrole);3,4-ditert-butyl-1H-pyrrole;bis(4,5-ditert-butyl-2H-triazole);ethane
CID 161156609
3,4-ditert-butyl-2,5-dihydrofuran;bis(4,5-ditert-butyl-2,3-dihydrofuran);bis(2,3-ditert-butylfuran);3,4-ditert-butylfuran;bis(4,5-ditert-butyl-1H-imidazole);bis(3,4-ditert-butyl-1,2-oxazole);bis(4,5-ditert-butyl-1,2-oxazole);4,5-ditert-butyl-1,3-oxazole;tetrakis(4,5-ditert-butyl-1H-pyrazole);bis(2,3-ditert-butyl-1H-pyrrole);3,4-ditert-butyl-1H-pyrrole;bis(4,5-ditert-butyl-2H-triazole);ethane
CID 161593213

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone?
The IUPAC name of 1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone (CID 159195077) is 1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone.
What is the SMILES notation for 1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone?
The canonical SMILES for 1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone is CC(=O)C1=CC(C)=NC1.CC(=O)C1=CC=CC1.CC(=O)C1=NC=CC1.CC(=O)c1cc(C)[nH]n1.CC(=O)c1cc(C)on1.CC(=O)c1cccn1C.CC(=O)c1ccco1.CC(=O)c1ccnn1C.CC(=O)c1ccnn1C.CC(=O)c1ccno1.CC(=O)c1cnc(N)o1.CC(=O)c1cnc[nH]1.CC(=O)c1cnco1.CC(=O)c1cocn1.CC(=O)c1nc(C)oc1C.CC(=O)c1nc(C)oc1C(F)(F)F.CC(=O)c1oc(C)nc1C.CC(=O)c1oc(N)nc1C.CC(=O)c1ocnc1C.
What is the InChIKey of 1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone?
The InChIKey is KOOHDSYBGMSAGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F3NO2.2C7H9NO2.2C7H9NO.C7H8O.C6H8N2O2.3C6H8N2O.2C6H7NO2.C6H7NO.C6H6O2.C5H6N2O2.C5H6N2O.3C5H5NO2/c1-3(12)5-6(7(8,9)10)13-4(2)11-5;1-4(9)7-5(2)10-6(3)8-7;1-4-7(5(2)9)10-6(3)8-4;1-5-3-7(4-8-5)6(2)9;1-6(9)7-4-3-5-8(7)2;1-6(8)7-4-2-3-5-7;1-3-5(4(2)9)10-6(7)8-3;2*1-5(9)6-3-4-7-8(6)2;1-4-3-6(5(2)9)8-7-4;1-4-6(5(2)8)9-3-7-4;1-4-3-6(5(2)8)7-9-4;1-5(8)6-3-2-4-7-6;1-5(7)6-3-2-4-8-6;1-3(8)4-2-7-5(6)9-4;1-4(8)5-2-6-3-7-5;1-4(7)5-2-8-3-6-5;1-4(7)5-2-6-3-8-5;1-4(7)5-2-3-6-8-5/h1-2H3;2*1-3H3;3H,4H2,1-2H3;3-5H,1-2H3;2-4H,5H2,1H3;1-2H3,(H2,7,8);2*3-4H,1-2H3;3H,1-2H3,(H,7,8);2*3H,1-2H3;2,4H,3H2,1H3;2-4H,1H3;2H,1H3,(H2,6,7);2-3H,1H3,(H,6,7);3*2-3H,1H3.
What are the key properties of 1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone?
1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone has a molecular weight of 2377.48 g/mol, XLogP of 20.28, 19 rotatable bonds, 4 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-4-methyl-1,3-oxazol-5-yl)ethanone;1-(2-amino-1,3-oxazol-5-yl)ethanone;1-cyclopenta-1,3-dien-1-ylethanone;1-(2,4-dimethyl-1,3-oxazol-5-yl)ethanone;1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanone;1-(furan-2-yl)ethanone;1-(1H-imidazol-5-yl)ethanone;1-(4-methyl-1,3-oxazol-5-yl)ethanone;1-(5-methyl-1,2-oxazol-3-yl)ethanone;bis(1-(2-methylpyrazol-3-yl)ethanone);1-(5-methyl-1H-pyrazol-3-yl)ethanone;1-(1-methylpyrrol-2-yl)ethanone;1-(5-methyl-2H-pyrrol-3-yl)ethanone;1-[2-methyl-5-(trifluoromethyl)-1,3-oxazol-4-yl]ethanone;1-(1,2-oxazol-5-yl)ethanone;1-(1,3-oxazol-4-yl)ethanone;1-(1,3-oxazol-5-yl)ethanone;1-(3H-pyrrol-2-yl)ethanone is sourced from PubChem (CID 159195077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).