About 1-(diethylamino)-3-methyl-1-phenylbutan-2-one;1-(4,4-difluoropiperidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-(dimethylamino)-3-methyl-1-phenylbutan-2-one;1-(2,5-dimethyl-4-oxohexan-3-yl)pyrrolidin-2-one;1-(ethylamino)-3-methyl-1-phenylbutan-2-one;1-[ethyl(propan-2-yl)amino]-3-methyl-1-phenylbutan-2-one;1-(3-fluoropyrrolidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-iodo-3-(2,2,5-trimethyl-4-oxohexan-3-yl)-1,3-diazinan-2-one;3-methyl-1-morpholin-4-yl-1-phenylbutan-2-one;1-(3-methyl-2-oxo-1-phenylbutyl)pyrrolidin-2-one;3-methyl-1-phenyl-1-piperidin-1-ylbutan-2-one;3-methyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one;1-(2,2,5-trimethyl-4-oxohexan-3-yl)imidazolidin-2-one;2,5,5-trimethyl-4-(pyrimidin-2-ylamino)hexan-3-one
1-(diethylamino)-3-methyl-1-phenylbutan-2-one;1-(4,4-difluoropiperidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-(dimethylamino)-3-methyl-1-phenylbutan-2-one;1-(2,5-dimethyl-4-oxohexan-3-yl)pyrrolidin-2-one;1-(ethylamino)-3-methyl-1-phenylbutan-2-one;1-[ethyl(propan-2-yl)amino]-3-methyl-1-phenylbutan-2-one;1-(3-fluoropyrrolidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-iodo-3-(2,2,5-trimethyl-4-oxohexan-3-yl)-1,3-diazinan-2-one;3-methyl-1-morpholin-4-yl-1-phenylbutan-2-one;1-(3-methyl-2-oxo-1-phenylbutyl)pyrrolidin-2-one;3-methyl-1-phenyl-1-piperidin-1-ylbutan-2-one;3-methyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one;1-(2,2,5-trimethyl-4-oxohexan-3-yl)imidazolidin-2-one;2,5,5-trimethyl-4-(pyrimidin-2-ylamino)hexan-3-one (PubChem CID 161294966) has the molecular formula C199H298F3IN18O19
and a molecular weight of 3430.58 g/mol. Its IUPAC name is 1-(diethylamino)-3-methyl-1-phenylbutan-2-one;1-(4,4-difluoropiperidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-(dimethylamino)-3-methyl-1-phenylbutan-2-one;1-(2,5-dimethyl-4-oxohexan-3-yl)pyrrolidin-2-one;1-(ethylamino)-3-methyl-1-phenylbutan-2-one;1-[ethyl(propan-2-yl)amino]-3-methyl-1-phenylbutan-2-one;1-(3-fluoropyrrolidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-iodo-3-(2,2,5-trimethyl-4-oxohexan-3-yl)-1,3-diazinan-2-one;3-methyl-1-morpholin-4-yl-1-phenylbutan-2-one;1-(3-methyl-2-oxo-1-phenylbutyl)pyrrolidin-2-one;3-methyl-1-phenyl-1-piperidin-1-ylbutan-2-one;3-methyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one;1-(2,2,5-trimethyl-4-oxohexan-3-yl)imidazolidin-2-one;2,5,5-trimethyl-4-(pyrimidin-2-ylamino)hexan-3-one.
Frequently Asked Questions
What is the IUPAC name of 1-(diethylamino)-3-methyl-1-phenylbutan-2-one;1-(4,4-difluoropiperidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-(dimethylamino)-3-methyl-1-phenylbutan-2-one;1-(2,5-dimethyl-4-oxohexan-3-yl)pyrrolidin-2-one;1-(ethylamino)-3-methyl-1-phenylbutan-2-one;1-[ethyl(propan-2-yl)amino]-3-methyl-1-phenylbutan-2-one;1-(3-fluoropyrrolidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-iodo-3-(2,2,5-trimethyl-4-oxohexan-3-yl)-1,3-diazinan-2-one;3-methyl-1-morpholin-4-yl-1-phenylbutan-2-one;1-(3-methyl-2-oxo-1-phenylbutyl)pyrrolidin-2-one;3-methyl-1-phenyl-1-piperidin-1-ylbutan-2-one;3-methyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one;1-(2,2,5-trimethyl-4-oxohexan-3-yl)imidazolidin-2-one;2,5,5-trimethyl-4-(pyrimidin-2-ylamino)hexan-3-one?
The IUPAC name of 1-(diethylamino)-3-methyl-1-phenylbutan-2-one;1-(4,4-difluoropiperidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-(dimethylamino)-3-methyl-1-phenylbutan-2-one;1-(2,5-dimethyl-4-oxohexan-3-yl)pyrrolidin-2-one;1-(ethylamino)-3-methyl-1-phenylbutan-2-one;1-[ethyl(propan-2-yl)amino]-3-methyl-1-phenylbutan-2-one;1-(3-fluoropyrrolidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-iodo-3-(2,2,5-trimethyl-4-oxohexan-3-yl)-1,3-diazinan-2-one;3-methyl-1-morpholin-4-yl-1-phenylbutan-2-one;1-(3-methyl-2-oxo-1-phenylbutyl)pyrrolidin-2-one;3-methyl-1-phenyl-1-piperidin-1-ylbutan-2-one;3-methyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one;1-(2,2,5-trimethyl-4-oxohexan-3-yl)imidazolidin-2-one;2,5,5-trimethyl-4-(pyrimidin-2-ylamino)hexan-3-one (CID 161294966) is 1-(diethylamino)-3-methyl-1-phenylbutan-2-one;1-(4,4-difluoropiperidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-(dimethylamino)-3-methyl-1-phenylbutan-2-one;1-(2,5-dimethyl-4-oxohexan-3-yl)pyrrolidin-2-one;1-(ethylamino)-3-methyl-1-phenylbutan-2-one;1-[ethyl(propan-2-yl)amino]-3-methyl-1-phenylbutan-2-one;1-(3-fluoropyrrolidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-iodo-3-(2,2,5-trimethyl-4-oxohexan-3-yl)-1,3-diazinan-2-one;3-methyl-1-morpholin-4-yl-1-phenylbutan-2-one;1-(3-methyl-2-oxo-1-phenylbutyl)pyrrolidin-2-one;3-methyl-1-phenyl-1-piperidin-1-ylbutan-2-one;3-methyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one;1-(2,2,5-trimethyl-4-oxohexan-3-yl)imidazolidin-2-one;2,5,5-trimethyl-4-(pyrimidin-2-ylamino)hexan-3-one.
What is the SMILES notation for 1-(diethylamino)-3-methyl-1-phenylbutan-2-one;1-(4,4-difluoropiperidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-(dimethylamino)-3-methyl-1-phenylbutan-2-one;1-(2,5-dimethyl-4-oxohexan-3-yl)pyrrolidin-2-one;1-(ethylamino)-3-methyl-1-phenylbutan-2-one;1-[ethyl(propan-2-yl)amino]-3-methyl-1-phenylbutan-2-one;1-(3-fluoropyrrolidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-iodo-3-(2,2,5-trimethyl-4-oxohexan-3-yl)-1,3-diazinan-2-one;3-methyl-1-morpholin-4-yl-1-phenylbutan-2-one;1-(3-methyl-2-oxo-1-phenylbutyl)pyrrolidin-2-one;3-methyl-1-phenyl-1-piperidin-1-ylbutan-2-one;3-methyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one;1-(2,2,5-trimethyl-4-oxohexan-3-yl)imidazolidin-2-one;2,5,5-trimethyl-4-(pyrimidin-2-ylamino)hexan-3-one?
The canonical SMILES for 1-(diethylamino)-3-methyl-1-phenylbutan-2-one;1-(4,4-difluoropiperidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-(dimethylamino)-3-methyl-1-phenylbutan-2-one;1-(2,5-dimethyl-4-oxohexan-3-yl)pyrrolidin-2-one;1-(ethylamino)-3-methyl-1-phenylbutan-2-one;1-[ethyl(propan-2-yl)amino]-3-methyl-1-phenylbutan-2-one;1-(3-fluoropyrrolidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-iodo-3-(2,2,5-trimethyl-4-oxohexan-3-yl)-1,3-diazinan-2-one;3-methyl-1-morpholin-4-yl-1-phenylbutan-2-one;1-(3-methyl-2-oxo-1-phenylbutyl)pyrrolidin-2-one;3-methyl-1-phenyl-1-piperidin-1-ylbutan-2-one;3-methyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one;1-(2,2,5-trimethyl-4-oxohexan-3-yl)imidazolidin-2-one;2,5,5-trimethyl-4-(pyrimidin-2-ylamino)hexan-3-one is CC(C)C(=O)C(C(C)C)N1CCCC1=O.CC(C)C(=O)C(N1CCCN(I)C1=O)C(C)(C)C.CC(C)C(=O)C(N1CCNC1=O)C(C)(C)C.CC(C)C(=O)C(Nc1ncccn1)C(C)(C)C.CC(C)C(=O)C(c1ccccc1)N(C)C.CC(C)C(=O)C(c1ccccc1)N1CCC(F)(F)CC1.CC(C)C(=O)C(c1ccccc1)N1CCC(F)C1.CC(C)C(=O)C(c1ccccc1)N1CCCC1.CC(C)C(=O)C(c1ccccc1)N1CCCC1=O.CC(C)C(=O)C(c1ccccc1)N1CCCCC1.CC(C)C(=O)C(c1ccccc1)N1CCOCC1.CCN(C(C)C)C(C(=O)C(C)C)c1ccccc1.CCN(CC)C(C(=O)C(C)C)c1ccccc1.CCNC(C(=O)C(C)C)c1ccccc1.
What is the InChIKey of 1-(diethylamino)-3-methyl-1-phenylbutan-2-one;1-(4,4-difluoropiperidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-(dimethylamino)-3-methyl-1-phenylbutan-2-one;1-(2,5-dimethyl-4-oxohexan-3-yl)pyrrolidin-2-one;1-(ethylamino)-3-methyl-1-phenylbutan-2-one;1-[ethyl(propan-2-yl)amino]-3-methyl-1-phenylbutan-2-one;1-(3-fluoropyrrolidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-iodo-3-(2,2,5-trimethyl-4-oxohexan-3-yl)-1,3-diazinan-2-one;3-methyl-1-morpholin-4-yl-1-phenylbutan-2-one;1-(3-methyl-2-oxo-1-phenylbutyl)pyrrolidin-2-one;3-methyl-1-phenyl-1-piperidin-1-ylbutan-2-one;3-methyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one;1-(2,2,5-trimethyl-4-oxohexan-3-yl)imidazolidin-2-one;2,5,5-trimethyl-4-(pyrimidin-2-ylamino)hexan-3-one?
The InChIKey is VGVVQAXITYLNIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21F2NO.C16H23NO.C16H25NO.C15H20FNO.C15H19NO2.C15H21NO2.C15H21NO.C15H23NO.C13H23IN2O2.C13H21N3O.2C13H19NO.C12H22N2O2.C12H21NO2/c1-12(2)15(20)14(13-6-4-3-5-7-13)19-10-8-16(17,18)9-11-19;1-13(2)16(18)15(14-9-5-3-6-10-14)17-11-7-4-8-12-17;1-6-17(13(4)5)15(16(18)12(2)3)14-10-8-7-9-11-14;1-11(2)15(18)14(12-6-4-3-5-7-12)17-9-8-13(16)10-17;1-11(2)15(18)14(12-7-4-3-5-8-12)16-10-6-9-13(16)17;1-12(2)15(17)14(13-6-4-3-5-7-13)16-8-10-18-11-9-16;1-12(2)15(17)14(16-10-6-7-11-16)13-8-4-3-5-9-13;1-5-16(6-2)14(15(17)12(3)4)13-10-8-7-9-11-13;1-9(2)10(17)11(13(3,4)5)15-7-6-8-16(14)12(15)18;1-9(2)10(17)11(13(3,4)5)16-12-14-7-6-8-15-12;1-10(2)13(15)12(14(3)4)11-8-6-5-7-9-11;1-4-14-12(13(15)10(2)3)11-8-6-5-7-9-11;1-8(2)9(15)10(12(3,4)5)14-7-6-13-11(14)16;1-8(2)11(12(15)9(3)4)13-7-5-6-10(13)14/h3-7,12,14H,8-11H2,1-2H3;3,5-6,9-10,13,15H,4,7-8,11-12H2,1-2H3;7-13,15H,6H2,1-5H3;3-7,11,13-14H,8-10H2,1-2H3;3-5,7-8,11,14H,6,9-10H2,1-2H3;3-7,12,14H,8-11H2,1-2H3;3-5,8-9,12,14H,6-7,10-11H2,1-2H3;7-12,14H,5-6H2,1-4H3;9,11H,6-8H2,1-5H3;6-9,11H,1-5H3,(H,14,15,16);5-10,12H,1-4H3;5-10,12,14H,4H2,1-3H3;8,10H,6-7H2,1-5H3,(H,13,16);8-9,11H,5-7H2,1-4H3.
What are the key properties of 1-(diethylamino)-3-methyl-1-phenylbutan-2-one;1-(4,4-difluoropiperidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-(dimethylamino)-3-methyl-1-phenylbutan-2-one;1-(2,5-dimethyl-4-oxohexan-3-yl)pyrrolidin-2-one;1-(ethylamino)-3-methyl-1-phenylbutan-2-one;1-[ethyl(propan-2-yl)amino]-3-methyl-1-phenylbutan-2-one;1-(3-fluoropyrrolidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-iodo-3-(2,2,5-trimethyl-4-oxohexan-3-yl)-1,3-diazinan-2-one;3-methyl-1-morpholin-4-yl-1-phenylbutan-2-one;1-(3-methyl-2-oxo-1-phenylbutyl)pyrrolidin-2-one;3-methyl-1-phenyl-1-piperidin-1-ylbutan-2-one;3-methyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one;1-(2,2,5-trimethyl-4-oxohexan-3-yl)imidazolidin-2-one;2,5,5-trimethyl-4-(pyrimidin-2-ylamino)hexan-3-one?
1-(diethylamino)-3-methyl-1-phenylbutan-2-one;1-(4,4-difluoropiperidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-(dimethylamino)-3-methyl-1-phenylbutan-2-one;1-(2,5-dimethyl-4-oxohexan-3-yl)pyrrolidin-2-one;1-(ethylamino)-3-methyl-1-phenylbutan-2-one;1-[ethyl(propan-2-yl)amino]-3-methyl-1-phenylbutan-2-one;1-(3-fluoropyrrolidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-iodo-3-(2,2,5-trimethyl-4-oxohexan-3-yl)-1,3-diazinan-2-one;3-methyl-1-morpholin-4-yl-1-phenylbutan-2-one;1-(3-methyl-2-oxo-1-phenylbutyl)pyrrolidin-2-one;3-methyl-1-phenyl-1-piperidin-1-ylbutan-2-one;3-methyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one;1-(2,2,5-trimethyl-4-oxohexan-3-yl)imidazolidin-2-one;2,5,5-trimethyl-4-(pyrimidin-2-ylamino)hexan-3-one has a molecular weight of 3430.58 g/mol, XLogP of 39.22, 59 rotatable bonds, 3 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(diethylamino)-3-methyl-1-phenylbutan-2-one;1-(4,4-difluoropiperidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-(dimethylamino)-3-methyl-1-phenylbutan-2-one;1-(2,5-dimethyl-4-oxohexan-3-yl)pyrrolidin-2-one;1-(ethylamino)-3-methyl-1-phenylbutan-2-one;1-[ethyl(propan-2-yl)amino]-3-methyl-1-phenylbutan-2-one;1-(3-fluoropyrrolidin-1-yl)-3-methyl-1-phenylbutan-2-one;1-iodo-3-(2,2,5-trimethyl-4-oxohexan-3-yl)-1,3-diazinan-2-one;3-methyl-1-morpholin-4-yl-1-phenylbutan-2-one;1-(3-methyl-2-oxo-1-phenylbutyl)pyrrolidin-2-one;3-methyl-1-phenyl-1-piperidin-1-ylbutan-2-one;3-methyl-1-phenyl-1-pyrrolidin-1-ylbutan-2-one;1-(2,2,5-trimethyl-4-oxohexan-3-yl)imidazolidin-2-one;2,5,5-trimethyl-4-(pyrimidin-2-ylamino)hexan-3-one is sourced from PubChem (CID 161294966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).