methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate

C161H149F2N27O27 — CID 159639654

About methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate

methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate (PubChem CID 159639654) has the molecular formula C161H149F2N27O27 and a molecular weight of 2932.12 g/mol. Its IUPAC name is methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate.

Molecular Properties

• Compound Name: methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate
• PubChem CID: 159639654
• Molecular Formula: C161H149F2N27O27
• Molecular Weight: 2932.12 g/mol
• Exact Mass: 2930.11
• IUPAC Name: methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate
• SMILES: CCc1ccc(COc2ccnn2-c2cc(C(=O)OC)ccn2)cc1.COC(=O)c1ccnc(-n2nccc2OCc2ccc(C)c(F)c2)c1.COC(=O)c1ccnc(-n2nccc2OCc2ccc(C)cc2)c1.COC(=O)c1ccnc(-n2nccc2OCc2ccc(C)cc2)c1.COC(=O)c1ccnc(-n2nccc2OCc2ccc(C)cc2)c1.COC(=O)c1ccnc(-n2nccc2OCc2ccc(C)cc2)c1.COC(=O)c1ccnc(-n2nccc2OCc2ccc(C)cc2)c1.COC(=O)c1ccnc(-n2nccc2OCc2cccc(F)c2)c1.COC(=O)c1ccnc(-n2nccc2OCc2ccccc2)c1
• InChI: InChI=1S/C19H19N3O3.C18H16FN3O3.5C18H17N3O3.C17H14FN3O3.C17H15N3O3/c1-3-14-4-6-15(7-5-14)13-25-18-9-11-21-22(18)17-12-16(8-10-20-17)19(23)24-2;1-12-3-4-13(9-15(12)19)11-25-17-6-8-21-22(17)16-10-14(5-7-20-16)18(23)24-2;5*1-13-3-5-14(6-4-13)12-24-17-8-10-20-21(17)16-11-15(7-9-19-16)18(22)23-2;1-23-17(22)13-5-7-19-15(10-13)21-16(6-8-20-21)24-11-12-3-2-4-14(18)9-12;1-22-17(21)14-7-9-18-15(11-14)20-16(8-10-19-20)23-12-13-5-3-2-4-6-13/h4-12H,3,13H2,1-2H3;3-10H,11H2,1-2H3;5*3-11H,12H2,1-2H3;2-10H,11H2,1H3;2-11H,12H2,1H3
• InChIKey: MQENUJXWCPCZKN-UHFFFAOYSA-N
• XLogP: 26.39
• TPSA: 596.16 Ų
• H-Bond Acceptors: 54
• Rotatable Bonds: 46
• Heavy Atoms: 217
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2932.12
LogP ≤ 5	26.39
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	54

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate?

The IUPAC name of methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate (CID 159639654) is methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate.

What is the SMILES notation for methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate?

The canonical SMILES for methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate is CCc1ccc(COc2ccnn2-c2cc(C(=O)OC)ccn2)cc1.COC(=O)c1ccnc(-n2nccc2OCc2ccc(C)c(F)c2)c1.COC(=O)c1ccnc(-n2nccc2OCc2ccc(C)cc2)c1.COC(=O)c1ccnc(-n2nccc2OCc2ccc(C)cc2)c1.COC(=O)c1ccnc(-n2nccc2OCc2ccc(C)cc2)c1.COC(=O)c1ccnc(-n2nccc2OCc2ccc(C)cc2)c1.COC(=O)c1ccnc(-n2nccc2OCc2ccc(C)cc2)c1.COC(=O)c1ccnc(-n2nccc2OCc2cccc(F)c2)c1.COC(=O)c1ccnc(-n2nccc2OCc2ccccc2)c1.

What is the InChIKey of methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate?

The InChIKey is MQENUJXWCPCZKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3.C18H16FN3O3.5C18H17N3O3.C17H14FN3O3.C17H15N3O3/c1-3-14-4-6-15(7-5-14)13-25-18-9-11-21-22(18)17-12-16(8-10-20-17)19(23)24-2;1-12-3-4-13(9-15(12)19)11-25-17-6-8-21-22(17)16-10-14(5-7-20-16)18(23)24-2;5*1-13-3-5-14(6-4-13)12-24-17-8-10-20-21(17)16-11-15(7-9-19-16)18(22)23-2;1-23-17(22)13-5-7-19-15(10-13)21-16(6-8-20-21)24-11-12-3-2-4-14(18)9-12;1-22-17(21)14-7-9-18-15(11-14)20-16(8-10-19-20)23-12-13-5-3-2-4-6-13/h4-12H,3,13H2,1-2H3;3-10H,11H2,1-2H3;5*3-11H,12H2,1-2H3;2-10H,11H2,1H3;2-11H,12H2,1H3.

What are the key properties of methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate?

methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate has a molecular weight of 2932.12 g/mol, XLogP of 26.39, 46 rotatable bonds, 0 hydrogen bond donors, and 54 hydrogen bond acceptors.

Where does this data come from?

All data for methyl 2-[5-[(4-ethylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluoro-4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;methyl 2-[5-[(3-fluorophenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate;pentakis(methyl 2-[5-[(4-methylphenyl)methoxy]pyrazol-1-yl]pyridine-4-carboxylate);methyl 2-(5-phenylmethoxypyrazol-1-yl)pyridine-4-carboxylate is sourced from PubChem (CID 159639654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).