N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide

C117H118F4N26O14 — CID 159318448

About N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide

N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide (PubChem CID 159318448) has the molecular formula C117H118F4N26O14 and a molecular weight of 2188.39 g/mol. Its IUPAC name is N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide.

Molecular Properties

• Compound Name: N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide
• PubChem CID: 159318448
• Molecular Formula: C117H118F4N26O14
• Molecular Weight: 2188.39 g/mol
• Exact Mass: 2186.93
• IUPAC Name: N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide
• SMILES: CCOc1cc(-c2ccc(F)cc2)nc2cc(C(=O)NCCc3cn[nH]n3)ccc12.CCOc1cc(-c2ccc(F)cc2OC)nc2cc(C(=O)NCCC3=CNNN3)ccc12.CCOc1cc(-c2ccc(F)cc2OC)nc2cc(C(=O)NCCCc3n[nH]nc3C)ccc12.CCOc1cc(-c2cccnc2OC)nc2cc(C(=O)NCCCc3cn[nH]n3)ccc12.COCCOc1cc(-c2ccc(F)cc2)nc2cc(C(=O)NCCCc3cn[nH]n3)ccc12
• InChI: InChI=1S/C25H26FN5O3.C24H24FN5O3.C23H24FN5O3.C23H24N6O3.C22H20FN5O2/c1-4-34-24-14-22(18-10-8-17(26)13-23(18)33-3)28-21-12-16(7-9-19(21)24)25(32)27-11-5-6-20-15(2)29-31-30-20;1-32-11-12-33-23-14-21(16-4-7-18(25)8-5-16)28-22-13-17(6-9-20(22)23)24(31)26-10-2-3-19-15-27-30-29-19;1-3-32-22-12-20(17-7-5-15(24)11-21(17)31-2)27-19-10-14(4-6-18(19)22)23(30)25-9-8-16-13-26-29-28-16;1-3-32-21-13-20(18-7-5-11-25-23(18)31-2)27-19-12-15(8-9-17(19)21)22(30)24-10-4-6-16-14-26-29-28-16;1-2-30-21-12-19(14-3-6-16(23)7-4-14)26-20-11-15(5-8-18(20)21)22(29)24-10-9-17-13-25-28-27-17/h7-10,12-14H,4-6,11H2,1-3H3,(H,27,32)(H,29,30,31);4-9,13-15H,2-3,10-12H2,1H3,(H,26,31)(H,27,29,30);4-7,10-13,26,28-29H,3,8-9H2,1-2H3,(H,25,30);5,7-9,11-14H,3-4,6,10H2,1-2H3,(H,24,30)(H,26,28,29);3-8,11-13H,2,9-10H2,1H3,(H,24,29)(H,25,27,28)
• InChIKey: LDLHGWYWPLYXOY-UHFFFAOYSA-N
• XLogP: 17.52
• TPSA: 508.28 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 31
• Rotatable Bonds: 43
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2188.39
LogP ≤ 5	17.52
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide?

The IUPAC name of N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide (CID 159318448) is N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide.

What is the SMILES notation for N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide?

The canonical SMILES for N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide is CCOc1cc(-c2ccc(F)cc2)nc2cc(C(=O)NCCc3cn[nH]n3)ccc12.CCOc1cc(-c2ccc(F)cc2OC)nc2cc(C(=O)NCCC3=CNNN3)ccc12.CCOc1cc(-c2ccc(F)cc2OC)nc2cc(C(=O)NCCCc3n[nH]nc3C)ccc12.CCOc1cc(-c2cccnc2OC)nc2cc(C(=O)NCCCc3cn[nH]n3)ccc12.COCCOc1cc(-c2ccc(F)cc2)nc2cc(C(=O)NCCCc3cn[nH]n3)ccc12.

What is the InChIKey of N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide?

The InChIKey is LDLHGWYWPLYXOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26FN5O3.C24H24FN5O3.C23H24FN5O3.C23H24N6O3.C22H20FN5O2/c1-4-34-24-14-22(18-10-8-17(26)13-23(18)33-3)28-21-12-16(7-9-19(21)24)25(32)27-11-5-6-20-15(2)29-31-30-20;1-32-11-12-33-23-14-21(16-4-7-18(25)8-5-16)28-22-13-17(6-9-20(22)23)24(31)26-10-2-3-19-15-27-30-29-19;1-3-32-22-12-20(17-7-5-15(24)11-21(17)31-2)27-19-10-14(4-6-18(19)22)23(30)25-9-8-16-13-26-29-28-16;1-3-32-21-13-20(18-7-5-11-25-23(18)31-2)27-19-12-15(8-9-17(19)21)22(30)24-10-4-6-16-14-26-29-28-16;1-2-30-21-12-19(14-3-6-16(23)7-4-14)26-20-11-15(5-8-18(20)21)22(29)24-10-9-17-13-25-28-27-17/h7-10,12-14H,4-6,11H2,1-3H3,(H,27,32)(H,29,30,31);4-9,13-15H,2-3,10-12H2,1H3,(H,26,31)(H,27,29,30);4-7,10-13,26,28-29H,3,8-9H2,1-2H3,(H,25,30);5,7-9,11-14H,3-4,6,10H2,1-2H3,(H,24,30)(H,26,28,29);3-8,11-13H,2,9-10H2,1H3,(H,24,29)(H,25,27,28).

What are the key properties of N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide?

N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide has a molecular weight of 2188.39 g/mol, XLogP of 17.52, 43 rotatable bonds, 12 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(2,3-dihydro-1H-triazol-4-yl)ethyl]-4-ethoxy-2-(4-fluoro-2-methoxyphenyl)quinoline-7-carboxamide;4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(5-methyl-2H-triazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide;2-(4-fluorophenyl)-4-(2-methoxyethoxy)-N-[3-(2H-triazol-4-yl)propyl]quinoline-7-carboxamide is sourced from PubChem (CID 159318448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).