6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole

C101H122ClN15O5S — CID 158325871

IUPAC6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole
SMILESCc1ccc2c(OC(C)(C)C)cc(-c3cccc(NC(C)C)n3)nc2c1Cl.Cc1ccc2c(OC(C)(C)C)cc(-c3ccn(C(C)C)n3)nc2c1.Cc1ccc2c(OC(C)(C)C)cc(-c3nc(C(C)C)cs3)nc2c1.Cc1ccc2c(OC(C)(C)C)cc(-c3nccc(C)n3)nc2c1.Cc1ccc2c(OC(C)(C)C)cc(-n3ccc(NC(C)C)n3)nc2c1
InChIInChI=1S/C22H26ClN3O.C20H26N4O.C20H25N3O.C20H24N2OS.C19H21N3O/c1-13(2)24-19-9-7-8-16(25-19)17-12-18(27-22(4,5)6)15-11-10-14(3)20(23)21(15)26-17;1-13(2)21-18-9-10-24(23-18)19-12-17(25-20(4,5)6)15-8-7-14(3)11-16(15)22-19;1-13(2)23-10-9-16(22-23)18-12-19(24-20(4,5)6)15-8-7-14(3)11-17(15)21-18;1-12(2)17-11-24-19(22-17)16-10-18(23-20(4,5)6)14-8-7-13(3)9-15(14)21-16;1-12-6-7-14-15(10-12)22-16(11-17(14)23-19(3,4)5)18-20-9-8-13(2)21-18/h7-13H,1-6H3,(H,24,25);7-13H,1-6H3,(H,21,23);7-13H,1-6H3;7-12H,1-6H3;6-11H,1-5H3
InChIKeyGPJXTHKSOLUSOS-UHFFFAOYSA-N
MW1693.71 g/mol
LogP26.60
Rot. Bonds16

About 6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole

6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole (PubChem CID 158325871) has the molecular formula C101H122ClN15O5S and a molecular weight of 1693.71 g/mol. Its IUPAC name is 6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole.

Molecular Properties

Compound Name6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole
PubChem CID158325871
Molecular FormulaC101H122ClN15O5S
Molecular Weight1693.71 g/mol
Exact Mass1691.92
IUPAC Name6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole
SMILESCc1ccc2c(OC(C)(C)C)cc(-c3cccc(NC(C)C)n3)nc2c1Cl.Cc1ccc2c(OC(C)(C)C)cc(-c3ccn(C(C)C)n3)nc2c1.Cc1ccc2c(OC(C)(C)C)cc(-c3nc(C(C)C)cs3)nc2c1.Cc1ccc2c(OC(C)(C)C)cc(-c3nccc(C)n3)nc2c1.Cc1ccc2c(OC(C)(C)C)cc(-n3ccc(NC(C)C)n3)nc2c1
InChIInChI=1S/C22H26ClN3O.C20H26N4O.C20H25N3O.C20H24N2OS.C19H21N3O/c1-13(2)24-19-9-7-8-16(25-19)17-12-18(27-22(4,5)6)15-11-10-14(3)20(23)21(15)26-17;1-13(2)21-18-9-10-24(23-18)19-12-17(25-20(4,5)6)15-8-7-14(3)11-16(15)22-19;1-13(2)23-10-9-16(22-23)18-12-19(24-20(4,5)6)15-8-7-14(3)11-17(15)21-18;1-12(2)17-11-24-19(22-17)16-10-18(23-20(4,5)6)14-8-7-13(3)9-15(14)21-16;1-12-6-7-14-15(10-12)22-16(11-17(14)23-19(3,4)5)18-20-9-8-13(2)21-18/h7-13H,1-6H3,(H,24,25);7-13H,1-6H3,(H,21,23);7-13H,1-6H3;7-12H,1-6H3;6-11H,1-5H3
InChIKeyGPJXTHKSOLUSOS-UHFFFAOYSA-N
XLogP26.60
TPSA221.86 Ų
H-Bond Donors2
H-Bond Acceptors21
Rotatable Bonds16
Heavy Atoms123
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001693.71
LogP ≤ 526.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1021

Analyze 6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole?
The IUPAC name of 6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole (CID 158325871) is 6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole.
What is the SMILES notation for 6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole?
The canonical SMILES for 6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole is Cc1ccc2c(OC(C)(C)C)cc(-c3cccc(NC(C)C)n3)nc2c1Cl.Cc1ccc2c(OC(C)(C)C)cc(-c3ccn(C(C)C)n3)nc2c1.Cc1ccc2c(OC(C)(C)C)cc(-c3nc(C(C)C)cs3)nc2c1.Cc1ccc2c(OC(C)(C)C)cc(-c3nccc(C)n3)nc2c1.Cc1ccc2c(OC(C)(C)C)cc(-n3ccc(NC(C)C)n3)nc2c1.
What is the InChIKey of 6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole?
The InChIKey is GPJXTHKSOLUSOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26ClN3O.C20H26N4O.C20H25N3O.C20H24N2OS.C19H21N3O/c1-13(2)24-19-9-7-8-16(25-19)17-12-18(27-22(4,5)6)15-11-10-14(3)20(23)21(15)26-17;1-13(2)21-18-9-10-24(23-18)19-12-17(25-20(4,5)6)15-8-7-14(3)11-16(15)22-19;1-13(2)23-10-9-16(22-23)18-12-19(24-20(4,5)6)15-8-7-14(3)11-17(15)21-18;1-12(2)17-11-24-19(22-17)16-10-18(23-20(4,5)6)14-8-7-13(3)9-15(14)21-16;1-12-6-7-14-15(10-12)22-16(11-17(14)23-19(3,4)5)18-20-9-8-13(2)21-18/h7-13H,1-6H3,(H,24,25);7-13H,1-6H3,(H,21,23);7-13H,1-6H3;7-12H,1-6H3;6-11H,1-5H3.
What are the key properties of 6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole?
6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole has a molecular weight of 1693.71 g/mol, XLogP of 26.60, 16 rotatable bonds, 2 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[8-chloro-7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyridin-2-amine;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(4-methylpyrimidin-2-yl)quinoline;7-methyl-4-[(2-methylpropan-2-yl)oxy]-2-(1-propan-2-ylpyrazol-3-yl)quinoline;1-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-ylpyrazol-3-amine;2-[7-methyl-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-4-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 158325871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).