About 2-amino-3-fluoro-5-methylbenzaldehyde;2-bromo-6-fluoro-4-methylaniline;5-(2-chloro-8-fluoro-6-methylquinolin-3-yl)-3-methyl-1,2,4-oxadiazole;2-fluoro-4-methylaniline;8-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-1,4-dioxa-8-azaspiro[4.5]decane;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-[(3S)-oxan-3-yl]piperidin-4-amine;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-one;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carbonitrile;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carboxylic acid
2-amino-3-fluoro-5-methylbenzaldehyde;2-bromo-6-fluoro-4-methylaniline;5-(2-chloro-8-fluoro-6-methylquinolin-3-yl)-3-methyl-1,2,4-oxadiazole;2-fluoro-4-methylaniline;8-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-1,4-dioxa-8-azaspiro[4.5]decane;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-[(3S)-oxan-3-yl]piperidin-4-amine;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-one;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carbonitrile;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carboxylic acid (PubChem CID 157118297) has the molecular formula C118H113BrClF9N22O13
and a molecular weight of 2333.68 g/mol. Its IUPAC name is 2-amino-3-fluoro-5-methylbenzaldehyde;2-bromo-6-fluoro-4-methylaniline;5-(2-chloro-8-fluoro-6-methylquinolin-3-yl)-3-methyl-1,2,4-oxadiazole;2-fluoro-4-methylaniline;8-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-1,4-dioxa-8-azaspiro[4.5]decane;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-[(3S)-oxan-3-yl]piperidin-4-amine;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-one;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carbonitrile;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carboxylic acid.
Frequently Asked Questions
What is the IUPAC name of 2-amino-3-fluoro-5-methylbenzaldehyde;2-bromo-6-fluoro-4-methylaniline;5-(2-chloro-8-fluoro-6-methylquinolin-3-yl)-3-methyl-1,2,4-oxadiazole;2-fluoro-4-methylaniline;8-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-1,4-dioxa-8-azaspiro[4.5]decane;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-[(3S)-oxan-3-yl]piperidin-4-amine;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-one;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carbonitrile;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carboxylic acid?
The IUPAC name of 2-amino-3-fluoro-5-methylbenzaldehyde;2-bromo-6-fluoro-4-methylaniline;5-(2-chloro-8-fluoro-6-methylquinolin-3-yl)-3-methyl-1,2,4-oxadiazole;2-fluoro-4-methylaniline;8-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-1,4-dioxa-8-azaspiro[4.5]decane;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-[(3S)-oxan-3-yl]piperidin-4-amine;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-one;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carbonitrile;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carboxylic acid (CID 157118297) is 2-amino-3-fluoro-5-methylbenzaldehyde;2-bromo-6-fluoro-4-methylaniline;5-(2-chloro-8-fluoro-6-methylquinolin-3-yl)-3-methyl-1,2,4-oxadiazole;2-fluoro-4-methylaniline;8-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-1,4-dioxa-8-azaspiro[4.5]decane;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-[(3S)-oxan-3-yl]piperidin-4-amine;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-one;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carbonitrile;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carboxylic acid.
What is the SMILES notation for 2-amino-3-fluoro-5-methylbenzaldehyde;2-bromo-6-fluoro-4-methylaniline;5-(2-chloro-8-fluoro-6-methylquinolin-3-yl)-3-methyl-1,2,4-oxadiazole;2-fluoro-4-methylaniline;8-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-1,4-dioxa-8-azaspiro[4.5]decane;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-[(3S)-oxan-3-yl]piperidin-4-amine;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-one;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carbonitrile;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carboxylic acid?
The canonical SMILES for 2-amino-3-fluoro-5-methylbenzaldehyde;2-bromo-6-fluoro-4-methylaniline;5-(2-chloro-8-fluoro-6-methylquinolin-3-yl)-3-methyl-1,2,4-oxadiazole;2-fluoro-4-methylaniline;8-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-1,4-dioxa-8-azaspiro[4.5]decane;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-[(3S)-oxan-3-yl]piperidin-4-amine;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-one;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carbonitrile;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carboxylic acid is Cc1cc(F)c(N)c(Br)c1.Cc1cc(F)c(N)c(C=O)c1.Cc1cc(F)c2[nH]c(=O)c(C#N)cc2c1.Cc1cc(F)c2[nH]c(=O)c(C(=O)O)cc2c1.Cc1cc(F)c2nc(Cl)c(-c3nc(C)no3)cc2c1.Cc1cc(F)c2nc(N3CCC(=O)CC3)c(-c3nc(C)no3)cc2c1.Cc1cc(F)c2nc(N3CCC(N[C@H]4CCCOC4)CC3)c(-c3nc(C)no3)cc2c1.Cc1cc(F)c2nc(N3CCC4(CC3)OCCO4)c(-c3nc(C)no3)cc2c1.Cc1ccc(N)c(F)c1.
What is the InChIKey of 2-amino-3-fluoro-5-methylbenzaldehyde;2-bromo-6-fluoro-4-methylaniline;5-(2-chloro-8-fluoro-6-methylquinolin-3-yl)-3-methyl-1,2,4-oxadiazole;2-fluoro-4-methylaniline;8-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-1,4-dioxa-8-azaspiro[4.5]decane;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-[(3S)-oxan-3-yl]piperidin-4-amine;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-one;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carbonitrile;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carboxylic acid?
The InChIKey is AHQUXGJLTPINGU-SWKBLGRISA-N. The full InChI is InChI=1S/C23H28FN5O2.C20H21FN4O3.C18H17FN4O2.C13H9ClFN3O.C11H7FN2O.C11H8FNO3.C8H8FNO.C7H7BrFN.C7H8FN/c1-14-10-16-12-19(23-25-15(2)28-31-23)22(27-21(16)20(24)11-14)29-7-5-17(6-8-29)26-18-4-3-9-30-13-18;1-12-9-14-11-15(19-22-13(2)24-28-19)18(23-17(14)16(21)10-12)25-5-3-20(4-6-25)26-7-8-27-20;1-10-7-12-9-14(18-20-11(2)22-25-18)17(21-16(12)15(19)8-10)23-5-3-13(24)4-6-23;1-6-3-8-5-9(13-16-7(2)18-19-13)12(14)17-11(8)10(15)4-6;1-6-2-7-4-8(5-13)11(15)14-10(7)9(12)3-6;1-5-2-6-4-7(11(15)16)10(14)13-9(6)8(12)3-5;1-5-2-6(4-11)8(10)7(9)3-5;1-4-2-5(8)7(10)6(9)3-4;1-5-2-3-7(9)6(8)4-5/h10-12,17-18,26H,3-9,13H2,1-2H3;9-11H,3-8H2,1-2H3;7-9H,3-6H2,1-2H3;3-5H,1-2H3;2-4H,1H3,(H,14,15);2-4H,1H3,(H,13,14)(H,15,16);2-4H,10H2,1H3;2-3H,10H2,1H3;2-4H,9H2,1H3/t18-;;;;;;;;/m0......../s1.
What are the key properties of 2-amino-3-fluoro-5-methylbenzaldehyde;2-bromo-6-fluoro-4-methylaniline;5-(2-chloro-8-fluoro-6-methylquinolin-3-yl)-3-methyl-1,2,4-oxadiazole;2-fluoro-4-methylaniline;8-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-1,4-dioxa-8-azaspiro[4.5]decane;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-[(3S)-oxan-3-yl]piperidin-4-amine;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-one;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carbonitrile;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carboxylic acid?
2-amino-3-fluoro-5-methylbenzaldehyde;2-bromo-6-fluoro-4-methylaniline;5-(2-chloro-8-fluoro-6-methylquinolin-3-yl)-3-methyl-1,2,4-oxadiazole;2-fluoro-4-methylaniline;8-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-1,4-dioxa-8-azaspiro[4.5]decane;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-[(3S)-oxan-3-yl]piperidin-4-amine;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-one;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carbonitrile;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carboxylic acid has a molecular weight of 2333.68 g/mol, XLogP of 23.31, 11 rotatable bonds, 7 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-fluoro-5-methylbenzaldehyde;2-bromo-6-fluoro-4-methylaniline;5-(2-chloro-8-fluoro-6-methylquinolin-3-yl)-3-methyl-1,2,4-oxadiazole;2-fluoro-4-methylaniline;8-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-1,4-dioxa-8-azaspiro[4.5]decane;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-[(3S)-oxan-3-yl]piperidin-4-amine;1-[8-fluoro-6-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]piperidin-4-one;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carbonitrile;8-fluoro-6-methyl-2-oxo-1H-quinoline-3-carboxylic acid is sourced from PubChem (CID 157118297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).