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

C121H122F3N23O12 — CID 158765905

IUPAC4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide
SMILESCCOc1cc(-c2cc(F)ccc2OC)nc2cc(C(=O)NCCCC3=NN=CC3)ccc12.CCOc1cc(-c2ccc(F)cc2)nc2cc(C(=O)NCCCc3cn[nH]c3C)ccc12.CCOc1cc(-c2ccc(F)cc2)nc2cc(C(=O)NCCc3n[nH]nc3C)ccc12.CCOc1cc(-c2cccnc2OC)nc2cc(C(=O)NCCCC3=NN=CC3)ccc12.CCOc1cc(-c2ccnc(C)c2)nc2cc(C(=O)NCCCC3=NN=CC3)ccc12
InChIInChI=1S/C25H25FN4O3.C25H25FN4O2.C24H25N5O3.C24H25N5O2.C23H22FN5O2/c1-3-33-24-15-22(20-14-17(26)7-9-23(20)32-2)29-21-13-16(6-8-19(21)24)25(31)27-11-4-5-18-10-12-28-30-18;1-3-32-24-14-22(17-6-9-20(26)10-7-17)29-23-13-18(8-11-21(23)24)25(31)27-12-4-5-19-15-28-30-16(19)2;1-3-32-22-15-21(19-7-5-12-26-24(19)31-2)28-20-14-16(8-9-18(20)22)23(30)25-11-4-6-17-10-13-27-29-17;1-3-31-23-15-21(17-8-11-25-16(2)13-17)28-22-14-18(6-7-20(22)23)24(30)26-10-4-5-19-9-12-27-29-19;1-3-31-22-13-20(15-4-7-17(24)8-5-15)26-21-12-16(6-9-18(21)22)23(30)25-11-10-19-14(2)27-29-28-19/h6-9,12-15H,3-5,10-11H2,1-2H3,(H,27,31);6-11,13-15H,3-5,12H2,1-2H3,(H,27,31)(H,28,30);5,7-9,12-15H,3-4,6,10-11H2,1-2H3,(H,25,30);6-8,11-15H,3-5,9-10H2,1-2H3,(H,26,30);4-9,12-13H,3,10-11H2,1-2H3,(H,25,30)(H,27,28,29)
InChIKeyIPGIAYKNPIDYMA-UHFFFAOYSA-N
MW2147.45 g/mol
LogP21.85
Rot. Bonds41

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

4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide (PubChem CID 158765905) has the molecular formula C121H122F3N23O12 and a molecular weight of 2147.45 g/mol. Its IUPAC name is 4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide.

Molecular Properties

Compound Name4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide
PubChem CID158765905
Molecular FormulaC121H122F3N23O12
Molecular Weight2147.45 g/mol
Exact Mass2145.96
IUPAC Name4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide
SMILESCCOc1cc(-c2cc(F)ccc2OC)nc2cc(C(=O)NCCCC3=NN=CC3)ccc12.CCOc1cc(-c2ccc(F)cc2)nc2cc(C(=O)NCCCc3cn[nH]c3C)ccc12.CCOc1cc(-c2ccc(F)cc2)nc2cc(C(=O)NCCc3n[nH]nc3C)ccc12.CCOc1cc(-c2cccnc2OC)nc2cc(C(=O)NCCCC3=NN=CC3)ccc12.CCOc1cc(-c2ccnc(C)c2)nc2cc(C(=O)NCCCC3=NN=CC3)ccc12
InChIInChI=1S/C25H25FN4O3.C25H25FN4O2.C24H25N5O3.C24H25N5O2.C23H22FN5O2/c1-3-33-24-15-22(20-14-17(26)7-9-23(20)32-2)29-21-13-16(6-8-19(21)24)25(31)27-11-4-5-18-10-12-28-30-18;1-3-32-24-14-22(17-6-9-20(26)10-7-17)29-23-13-18(8-11-21(23)24)25(31)27-12-4-5-19-15-28-30-16(19)2;1-3-32-22-15-21(19-7-5-12-26-24(19)31-2)28-20-14-16(8-9-18(20)22)23(30)25-11-4-6-17-10-13-27-29-17;1-3-31-23-15-21(17-8-11-25-16(2)13-17)28-22-14-18(6-7-20(22)23)24(30)26-10-4-5-19-9-12-27-29-19;1-3-31-22-13-20(15-4-7-17(24)8-5-15)26-21-12-16(6-9-18(21)22)23(30)25-11-10-19-14(2)27-29-28-19/h6-9,12-15H,3-5,10-11H2,1-2H3,(H,27,31);6-11,13-15H,3-5,12H2,1-2H3,(H,27,31)(H,28,30);5,7-9,12-15H,3-4,6,10-11H2,1-2H3,(H,25,30);6-8,11-15H,3-5,9-10H2,1-2H3,(H,26,30);4-9,12-13H,3,10-11H2,1-2H3,(H,25,30)(H,27,28,29)
InChIKeyIPGIAYKNPIDYMA-UHFFFAOYSA-N
XLogP21.85
TPSA444.75 Ų
H-Bond Donors7
H-Bond Acceptors28
Rotatable Bonds41
Heavy Atoms159
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002147.45
LogP ≤ 521.85
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

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

Analyze 4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[2-(5-methyl-1H-pyrazol-4-yl)ethyl]quinoline-7-carboxamide
CID 122431380
4-ethoxy-2-(4-fluoro-2-methoxyphenyl)-N-[3-(1H-pyrazol-5-yl)propyl]quinoline-7-carboxamide
CID 122431466
4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide
CID 134164650
4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[2-(2H-triazol-4-yl)ethyl]quinoline-7-carboxamide
CID 122431457
4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[2-(5-methyl-1H-pyrazol-4-yl)ethyl]quinoline-7-carboxamide
CID 122431560
4-ethoxy-2-(6-methoxy-3-pyridinyl)-N-[2-(5-methyl-1H-pyrazol-4-yl)ethyl]quinoline-7-carboxamide
CID 122431563
4-ethoxy-N-[2-(5-methyl-1H-pyrazol-4-yl)ethyl]-2-(2-methyl-4-pyridinyl)quinoline-7-carboxamide
CID 122431574
4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(1H-pyrazol-5-yl)propyl]quinoline-7-carboxamide
CID 122431575
4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(1H-pyrazol-5-yl)propyl]quinoline-7-carboxamide
CID 122431593
4-ethoxy-2-(6-methoxy-3-pyridinyl)-N-[3-(1H-pyrazol-5-yl)propyl]quinoline-7-carboxamide
CID 122431594
4-ethoxy-2-(2-methoxy-4-pyridinyl)-N-[2-(5-methyl-1H-pyrazol-4-yl)ethyl]quinoline-7-carboxamide
CID 122431652
4-ethoxy-2-(2-methoxy-4-pyridinyl)-N-[3-(1H-pyrazol-5-yl)propyl]quinoline-7-carboxamide
CID 122431676

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide?
The IUPAC name of 4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide (CID 158765905) is 4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide.
What is the SMILES notation for 4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide?
The canonical SMILES for 4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide is CCOc1cc(-c2cc(F)ccc2OC)nc2cc(C(=O)NCCCC3=NN=CC3)ccc12.CCOc1cc(-c2ccc(F)cc2)nc2cc(C(=O)NCCCc3cn[nH]c3C)ccc12.CCOc1cc(-c2ccc(F)cc2)nc2cc(C(=O)NCCc3n[nH]nc3C)ccc12.CCOc1cc(-c2cccnc2OC)nc2cc(C(=O)NCCCC3=NN=CC3)ccc12.CCOc1cc(-c2ccnc(C)c2)nc2cc(C(=O)NCCCC3=NN=CC3)ccc12.
What is the InChIKey of 4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide?
The InChIKey is IPGIAYKNPIDYMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25FN4O3.C25H25FN4O2.C24H25N5O3.C24H25N5O2.C23H22FN5O2/c1-3-33-24-15-22(20-14-17(26)7-9-23(20)32-2)29-21-13-16(6-8-19(21)24)25(31)27-11-4-5-18-10-12-28-30-18;1-3-32-24-14-22(17-6-9-20(26)10-7-17)29-23-13-18(8-11-21(23)24)25(31)27-12-4-5-19-15-28-30-16(19)2;1-3-32-22-15-21(19-7-5-12-26-24(19)31-2)28-20-14-16(8-9-18(20)22)23(30)25-11-4-6-17-10-13-27-29-17;1-3-31-23-15-21(17-8-11-25-16(2)13-17)28-22-14-18(6-7-20(22)23)24(30)26-10-4-5-19-9-12-27-29-19;1-3-31-22-13-20(15-4-7-17(24)8-5-15)26-21-12-16(6-9-18(21)22)23(30)25-11-10-19-14(2)27-29-28-19/h6-9,12-15H,3-5,10-11H2,1-2H3,(H,27,31);6-11,13-15H,3-5,12H2,1-2H3,(H,27,31)(H,28,30);5,7-9,12-15H,3-4,6,10-11H2,1-2H3,(H,25,30);6-8,11-15H,3-5,9-10H2,1-2H3,(H,26,30);4-9,12-13H,3,10-11H2,1-2H3,(H,25,30)(H,27,28,29).
What are the key properties of 4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide?
4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide has a molecular weight of 2147.45 g/mol, XLogP of 21.85, 41 rotatable bonds, 7 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-2-(5-fluoro-2-methoxyphenyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(4-fluorophenyl)-N-[2-(5-methyl-2H-triazol-4-yl)ethyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methoxy-3-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide;4-ethoxy-2-(2-methyl-4-pyridinyl)-N-[3-(4H-pyrazol-3-yl)propyl]quinoline-7-carboxamide is sourced from PubChem (CID 158765905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).