About 5-(2-chloro-3-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chloro-4-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(5-fluoro-2-pyridinyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-pyrimidin-4-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2,5-difluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;2-(3-fluoro-5-isocyanophenyl)-5-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-fluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-methyl-2-(2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)benzonitrile
5-(2-chloro-3-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chloro-4-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(5-fluoro-2-pyridinyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-pyrimidin-4-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2,5-difluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;2-(3-fluoro-5-isocyanophenyl)-5-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-fluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-methyl-2-(2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)benzonitrile (PubChem CID 158691585) has the molecular formula C156H128Cl5F5N30O9S
and a molecular weight of 2871.26 g/mol. Its IUPAC name is 5-(2-chloro-3-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chloro-4-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(5-fluoro-2-pyridinyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-pyrimidin-4-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2,5-difluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;2-(3-fluoro-5-isocyanophenyl)-5-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-fluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-methyl-2-(2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)benzonitrile.
Frequently Asked Questions
What is the IUPAC name of 5-(2-chloro-3-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chloro-4-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(5-fluoro-2-pyridinyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-pyrimidin-4-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2,5-difluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;2-(3-fluoro-5-isocyanophenyl)-5-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-fluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-methyl-2-(2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)benzonitrile?
The IUPAC name of 5-(2-chloro-3-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chloro-4-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(5-fluoro-2-pyridinyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-pyrimidin-4-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2,5-difluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;2-(3-fluoro-5-isocyanophenyl)-5-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-fluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-methyl-2-(2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)benzonitrile (CID 158691585) is 5-(2-chloro-3-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chloro-4-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(5-fluoro-2-pyridinyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-pyrimidin-4-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2,5-difluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;2-(3-fluoro-5-isocyanophenyl)-5-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-fluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-methyl-2-(2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)benzonitrile.
What is the SMILES notation for 5-(2-chloro-3-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chloro-4-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(5-fluoro-2-pyridinyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-pyrimidin-4-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2,5-difluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;2-(3-fluoro-5-isocyanophenyl)-5-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-fluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-methyl-2-(2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)benzonitrile?
The canonical SMILES for 5-(2-chloro-3-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chloro-4-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(5-fluoro-2-pyridinyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-pyrimidin-4-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2,5-difluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;2-(3-fluoro-5-isocyanophenyl)-5-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-fluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-methyl-2-(2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)benzonitrile is Cc1ccc(N2CCc3oc(-c4ccccn4)nc3C2)c(C#N)c1.Cc1ccc(N2CCc3oc(-c4ccccn4)nc3C2)c(Cl)c1.Cc1cccc(N2CCc3oc(-c4ccccn4)nc3C2)c1Cl.Cc1nc(-c2nc3c(o2)CCN(c2ccccc2Cl)C3)cs1.Clc1ccccc1N1CCc2oc(-c3ccncn3)nc2C1.Fc1ccc(-c2nc3c(o2)CCN(c2ccccc2Cl)C3)nc1.Fc1ccc(F)c(N2CCc3oc(-c4ccccn4)nc3C2)c1.Fc1ccccc1N1CCc2oc(-c3ccccn3)nc2C1.[C-]#[N+]c1cc(F)cc(-c2nc3c(o2)CCN(c2ccccn2)C3)c1.
What is the InChIKey of 5-(2-chloro-3-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chloro-4-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(5-fluoro-2-pyridinyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-pyrimidin-4-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2,5-difluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;2-(3-fluoro-5-isocyanophenyl)-5-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-fluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-methyl-2-(2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)benzonitrile?
The InChIKey is IGKKPNRYPOFBOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O.2C18H16ClN3O.C18H13FN4O.C17H13ClFN3O.C17H13F2N3O.C17H14FN3O.C16H13ClN4O.C16H14ClN3OS/c1-13-5-6-17(14(10-13)11-20)23-9-7-18-16(12-23)22-19(24-18)15-4-2-3-8-21-15;1-12-5-4-7-15(17(12)19)22-10-8-16-14(11-22)21-18(23-16)13-6-2-3-9-20-13;1-12-5-6-16(13(19)10-12)22-9-7-17-15(11-22)21-18(23-17)14-4-2-3-8-20-14;1-20-14-9-12(8-13(19)10-14)18-22-15-11-23(7-5-16(15)24-18)17-4-2-3-6-21-17;18-12-3-1-2-4-15(12)22-8-7-16-14(10-22)21-17(23-16)13-6-5-11(19)9-20-13;18-11-4-5-12(19)15(9-11)22-8-6-16-14(10-22)21-17(23-16)13-3-1-2-7-20-13;18-12-5-1-2-7-15(12)21-10-8-16-14(11-21)20-17(22-16)13-6-3-4-9-19-13;17-11-3-1-2-4-14(11)21-8-6-15-13(9-21)20-16(22-15)12-5-7-18-10-19-12;1-10-18-13(9-22-10)16-19-12-8-20(7-6-15(12)21-16)14-5-3-2-4-11(14)17/h2-6,8,10H,7,9,12H2,1H3;2-7,9H,8,10-11H2,1H3;2-6,8,10H,7,9,11H2,1H3;2-4,6,8-10H,5,7,11H2;1-6,9H,7-8,10H2;1-5,7,9H,6,8,10H2;1-7,9H,8,10-11H2;1-5,7,10H,6,8-9H2;2-5,9H,6-8H2,1H3.
What are the key properties of 5-(2-chloro-3-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chloro-4-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(5-fluoro-2-pyridinyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-pyrimidin-4-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2,5-difluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;2-(3-fluoro-5-isocyanophenyl)-5-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-fluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-methyl-2-(2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)benzonitrile?
5-(2-chloro-3-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chloro-4-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(5-fluoro-2-pyridinyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-pyrimidin-4-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2,5-difluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;2-(3-fluoro-5-isocyanophenyl)-5-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-fluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-methyl-2-(2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)benzonitrile has a molecular weight of 2871.26 g/mol, XLogP of 34.77, 18 rotatable bonds, 0 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chloro-3-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chloro-4-methylphenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(5-fluoro-2-pyridinyl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-(2-methyl-1,3-thiazol-4-yl)-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-chlorophenyl)-2-pyrimidin-4-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2,5-difluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;2-(3-fluoro-5-isocyanophenyl)-5-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-(2-fluorophenyl)-2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridine;5-methyl-2-(2-pyridin-2-yl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-5-yl)benzonitrile is sourced from PubChem (CID 158691585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).