5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline

C146H174ClF8N21O3S3 — CID 162136001

About 5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline

5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline (PubChem CID 162136001) has the molecular formula C146H174ClF8N21O3S3 and a molecular weight of 2554.78 g/mol. Its IUPAC name is 5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline.

Molecular Properties

• Compound Name: 5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline
• PubChem CID: 162136001
• Molecular Formula: C146H174ClF8N21O3S3
• Molecular Weight: 2554.78 g/mol
• Exact Mass: 2552.28
• IUPAC Name: 5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline
• SMILES: CC(C)N1CCCc2cc(-c3cccs3)c(C(F)F)cc21.CC(C)N1CCCc2cc(-c3cnc(C4CC4)s3)c(C(F)F)cc21.CC(C)N1CCCc2cc(-c3cnn(C)c3)c(C3COC3)cc21.CC(C)N1C[C@@H](C)Cc2cc(-c3cnn(C)c3)c(C#N)cc21.CC(C)N1C[C@H](C)Cc2cc(-c3cnn(C)c3)c(C#N)cc21.CNC(=O)c1ccc(-c2cc3c(cc2Cl)N(C(C)C)CCC3)cn1.COc1ncc(-c2cc3c(cc2C(F)F)N(C(C)C)CCC3)cn1.Cc1ccc(-c2cc3c(cc2C(F)F)N(C(C)C)CCC3)s1
• InChI: InChI=1S/C19H22ClN3O.C19H22F2N2S.C19H25N3O.C18H21F2N3O.C18H21F2NS.2C18H22N4.C17H19F2NS/c1-12(2)23-8-4-5-13-9-15(16(20)10-18(13)23)14-6-7-17(22-11-14)19(24)21-3;1-11(2)23-7-3-4-13-8-14(15(18(20)21)9-16(13)23)17-10-22-19(24-17)12-5-6-12;1-13(2)22-6-4-5-14-7-17(15-9-20-21(3)10-15)18(8-19(14)22)16-11-23-12-16;1-11(2)23-6-4-5-12-7-14(15(17(19)20)8-16(12)23)13-9-21-18(24-3)22-10-13;1-11(2)21-8-4-5-13-9-14(17-7-6-12(3)22-17)15(18(19)20)10-16(13)21;2*1-12(2)22-10-13(3)5-14-6-17(15(8-19)7-18(14)22)16-9-20-21(4)11-16;1-11(2)20-7-3-5-12-9-13(16-6-4-8-21-16)14(17(18)19)10-15(12)20/h6-7,9-12H,4-5,8H2,1-3H3,(H,21,24);8-12,18H,3-7H2,1-2H3;7-10,13,16H,4-6,11-12H2,1-3H3;7-11,17H,4-6H2,1-3H3;6-7,9-11,18H,4-5,8H2,1-3H3;2*6-7,9,11-13H,5,10H2,1-4H3;4,6,8-11,17H,3,5,7H2,1-2H3/t;;;;;2*13-;/m.....10./s1
• InChIKey: ZJHHPPAQMWVTJJ-KWLKDQINSA-N
• XLogP: 35.39
• TPSA: 226.08 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 26
• Rotatable Bonds: 24
• Heavy Atoms: 182
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2554.78
LogP ≤ 5	35.39
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline?

The IUPAC name of 5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline (CID 162136001) is 5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline.

What is the SMILES notation for 5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline?

The canonical SMILES for 5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline is CC(C)N1CCCc2cc(-c3cccs3)c(C(F)F)cc21.CC(C)N1CCCc2cc(-c3cnc(C4CC4)s3)c(C(F)F)cc21.CC(C)N1CCCc2cc(-c3cnn(C)c3)c(C3COC3)cc21.CC(C)N1C[C@@H](C)Cc2cc(-c3cnn(C)c3)c(C#N)cc21.CC(C)N1C[C@H](C)Cc2cc(-c3cnn(C)c3)c(C#N)cc21.CNC(=O)c1ccc(-c2cc3c(cc2Cl)N(C(C)C)CCC3)cn1.COc1ncc(-c2cc3c(cc2C(F)F)N(C(C)C)CCC3)cn1.Cc1ccc(-c2cc3c(cc2C(F)F)N(C(C)C)CCC3)s1.

What is the InChIKey of 5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline?

The InChIKey is ZJHHPPAQMWVTJJ-KWLKDQINSA-N. The full InChI is InChI=1S/C19H22ClN3O.C19H22F2N2S.C19H25N3O.C18H21F2N3O.C18H21F2NS.2C18H22N4.C17H19F2NS/c1-12(2)23-8-4-5-13-9-15(16(20)10-18(13)23)14-6-7-17(22-11-14)19(24)21-3;1-11(2)23-7-3-4-13-8-14(15(18(20)21)9-16(13)23)17-10-22-19(24-17)12-5-6-12;1-13(2)22-6-4-5-14-7-17(15-9-20-21(3)10-15)18(8-19(14)22)16-11-23-12-16;1-11(2)23-6-4-5-12-7-14(15(17(19)20)8-16(12)23)13-9-21-18(24-3)22-10-13;1-11(2)21-8-4-5-13-9-14(17-7-6-12(3)22-17)15(18(19)20)10-16(13)21;2*1-12(2)22-10-13(3)5-14-6-17(15(8-19)7-18(14)22)16-9-20-21(4)11-16;1-11(2)20-7-3-5-12-9-13(16-6-4-8-21-16)14(17(18)19)10-15(12)20/h6-7,9-12H,4-5,8H2,1-3H3,(H,21,24);8-12,18H,3-7H2,1-2H3;7-10,13,16H,4-6,11-12H2,1-3H3;7-11,17H,4-6H2,1-3H3;6-7,9-11,18H,4-5,8H2,1-3H3;2*6-7,9,11-13H,5,10H2,1-4H3;4,6,8-11,17H,3,5,7H2,1-2H3/t;;;;;2*13-;/m.....10./s1.

What are the key properties of 5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline?

5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline has a molecular weight of 2554.78 g/mol, XLogP of 35.39, 24 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(7-chloro-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl)-N-methylpyridine-2-carboxamide;2-cyclopropyl-5-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1,3-thiazole;7-(difluoromethyl)-6-(2-methoxypyrimidin-5-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(5-methylthiophen-2-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-1-propan-2-yl-6-thiophen-2-yl-3,4-dihydro-2H-quinoline;(3R)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;(3S)-3-methyl-6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline-7-carbonitrile;6-(1-methylpyrazol-4-yl)-7-(oxetan-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline is sourced from PubChem (CID 162136001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).