2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide

C136H111F6N23O9S4 — CID 158284343

About 2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide

2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide (PubChem CID 158284343) has the molecular formula C136H111F6N23O9S4 and a molecular weight of 2453.79 g/mol. Its IUPAC name is 2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide.

Molecular Properties

• Compound Name: 2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide
• PubChem CID: 158284343
• Molecular Formula: C136H111F6N23O9S4
• Molecular Weight: 2453.79 g/mol
• Exact Mass: 2451.77
• IUPAC Name: 2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide
• SMILES: CC(F)(F)Oc1cccc(-c2ccc3cccc(C(=O)Nc4nc(CN5CCOCC5)cs4)c3n2)c1.CC(F)(F)c1cccc(-c2ccc3cccc(C(=O)Nc4nc(CN5CCOCC5)cs4)c3n2)c1.Cc1cc(-c2ccc3cccc(NC(=O)c4ccccn4)c3n2)ccc1F.Cc1cc(-c2ccc3cccc(NC(=O)c4ccccn4)c3n2)ccc1F.Cc1ccc(-c2ccc3cccc(NC(=O)c4cscn4)c3n2)cn1.O=C(Nc1nccs1)c1cccc2ccc(-c3ccnc(N4CCC4)c3)nc12
• InChI: InChI=1S/C26H24F2N4O3S.C26H24F2N4O2S.2C22H16FN3O.C21H17N5OS.C19H14N4OS/c1-26(27,28)35-20-6-2-5-18(14-20)22-9-8-17-4-3-7-21(23(17)30-22)24(33)31-25-29-19(16-36-25)15-32-10-12-34-13-11-32;1-26(27,28)19-6-2-5-18(14-19)22-9-8-17-4-3-7-21(23(17)30-22)24(33)31-25-29-20(16-35-25)15-32-10-12-34-13-11-32;2*1-14-13-16(8-10-17(14)23)18-11-9-15-5-4-7-19(21(15)25-18)26-22(27)20-6-2-3-12-24-20;27-20(25-21-23-9-12-28-21)16-4-1-3-14-5-6-17(24-19(14)16)15-7-8-22-18(13-15)26-10-2-11-26;1-12-5-6-14(9-20-12)15-8-7-13-3-2-4-16(18(13)22-15)23-19(24)17-10-25-11-21-17/h2-9,14,16H,10-13,15H2,1H3,(H,29,31,33);2-9,14,16H,10-13,15H2,1H3,(H,29,31,33);2*2-13H,1H3,(H,26,27);1,3-9,12-13H,2,10-11H2,(H,23,25,27);2-11H,1H3,(H,23,24)
• InChIKey: GKPBOTZZXGBSHL-UHFFFAOYSA-N
• XLogP: 29.51
• TPSA: 392.47 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 30
• Rotatable Bonds: 26
• Heavy Atoms: 178
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2453.79
LogP ≤ 5	29.51
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of 2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide?

The IUPAC name of 2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide (CID 158284343) is 2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide.

What is the SMILES notation for 2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide?

The canonical SMILES for 2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide is CC(F)(F)Oc1cccc(-c2ccc3cccc(C(=O)Nc4nc(CN5CCOCC5)cs4)c3n2)c1.CC(F)(F)c1cccc(-c2ccc3cccc(C(=O)Nc4nc(CN5CCOCC5)cs4)c3n2)c1.Cc1cc(-c2ccc3cccc(NC(=O)c4ccccn4)c3n2)ccc1F.Cc1cc(-c2ccc3cccc(NC(=O)c4ccccn4)c3n2)ccc1F.Cc1ccc(-c2ccc3cccc(NC(=O)c4cscn4)c3n2)cn1.O=C(Nc1nccs1)c1cccc2ccc(-c3ccnc(N4CCC4)c3)nc12.

What is the InChIKey of 2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide?

The InChIKey is GKPBOTZZXGBSHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24F2N4O3S.C26H24F2N4O2S.2C22H16FN3O.C21H17N5OS.C19H14N4OS/c1-26(27,28)35-20-6-2-5-18(14-20)22-9-8-17-4-3-7-21(23(17)30-22)24(33)31-25-29-19(16-36-25)15-32-10-12-34-13-11-32;1-26(27,28)19-6-2-5-18(14-19)22-9-8-17-4-3-7-21(23(17)30-22)24(33)31-25-29-20(16-35-25)15-32-10-12-34-13-11-32;2*1-14-13-16(8-10-17(14)23)18-11-9-15-5-4-7-19(21(15)25-18)26-22(27)20-6-2-3-12-24-20;27-20(25-21-23-9-12-28-21)16-4-1-3-14-5-6-17(24-19(14)16)15-7-8-22-18(13-15)26-10-2-11-26;1-12-5-6-14(9-20-12)15-8-7-13-3-2-4-16(18(13)22-15)23-19(24)17-10-25-11-21-17/h2-9,14,16H,10-13,15H2,1H3,(H,29,31,33);2-9,14,16H,10-13,15H2,1H3,(H,29,31,33);2*2-13H,1H3,(H,26,27);1,3-9,12-13H,2,10-11H2,(H,23,25,27);2-11H,1H3,(H,23,24).

What are the key properties of 2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide?

2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide has a molecular weight of 2453.79 g/mol, XLogP of 29.51, 26 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-(azetidin-1-yl)-4-pyridinyl]-N-(1,3-thiazol-2-yl)quinoline-8-carboxamide;2-[3-(1,1-difluoroethoxy)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;2-[3-(1,1-difluoroethyl)phenyl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]quinoline-8-carboxamide;bis(N-[2-(4-fluoro-3-methylphenyl)quinolin-8-yl]pyridine-2-carboxamide);N-[2-(6-methyl-3-pyridinyl)quinolin-8-yl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 158284343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).