5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde

C81H86F3N17O14 — CID 158700643

About 5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde

5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde (PubChem CID 158700643) has the molecular formula C81H86F3N17O14 and a molecular weight of 1578.68 g/mol. Its IUPAC name is 5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde.

Molecular Properties

• Compound Name: 5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde
• PubChem CID: 158700643
• Molecular Formula: C81H86F3N17O14
• Molecular Weight: 1578.68 g/mol
• Exact Mass: 1577.65
• IUPAC Name: 5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde
• SMILES: CC(C)n1nccc1-c1ncccc1COc1cnc(OCCN2CCOCC2)cc1C=O.CCn1ncc(C)c1-c1ncccc1COc1cnc(OC)cc1C=O.CCn1nccc1-c1ncccc1COc1cnc(OCCOC)cc1C=O.COc1cc(C=O)c(OCc2cccnc2-c2ccn(CC(F)(F)F)n2)cn1
• InChI: InChI=1S/C24H29N5O4.C20H22N4O4.C19H20N4O3.C18H15F3N4O3/c1-18(2)29-21(5-7-27-29)24-19(4-3-6-25-24)17-33-22-15-26-23(14-20(22)16-30)32-13-10-28-8-11-31-12-9-28;1-3-24-17(6-8-23-24)20-15(5-4-7-21-20)14-28-18-12-22-19(11-16(18)13-25)27-10-9-26-2;1-4-23-19(13(2)9-22-23)18-14(6-5-7-20-18)12-26-16-10-21-17(25-3)8-15(16)11-24;1-27-16-7-13(9-26)15(8-23-16)28-10-12-3-2-5-22-17(12)14-4-6-25(24-14)11-18(19,20)21/h3-7,14-16,18H,8-13,17H2,1-2H3;4-8,11-13H,3,9-10,14H2,1-2H3;5-11H,4,12H2,1-3H3;2-9H,10-11H2,1H3
• InChIKey: IHMRMPVPNZXECF-UHFFFAOYSA-N
• XLogP: 12.17
• TPSA: 338.22 Ų
• H-Bond Acceptors: 31
• Rotatable Bonds: 34
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1578.68
LogP ≤ 5	12.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde?

The IUPAC name of 5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde (CID 158700643) is 5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde.

What is the SMILES notation for 5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde?

The canonical SMILES for 5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde is CC(C)n1nccc1-c1ncccc1COc1cnc(OCCN2CCOCC2)cc1C=O.CCn1ncc(C)c1-c1ncccc1COc1cnc(OC)cc1C=O.CCn1nccc1-c1ncccc1COc1cnc(OCCOC)cc1C=O.COc1cc(C=O)c(OCc2cccnc2-c2ccn(CC(F)(F)F)n2)cn1.

What is the InChIKey of 5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde?

The InChIKey is IHMRMPVPNZXECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5O4.C20H22N4O4.C19H20N4O3.C18H15F3N4O3/c1-18(2)29-21(5-7-27-29)24-19(4-3-6-25-24)17-33-22-15-26-23(14-20(22)16-30)32-13-10-28-8-11-31-12-9-28;1-3-24-17(6-8-23-24)20-15(5-4-7-21-20)14-28-18-12-22-19(11-16(18)13-25)27-10-9-26-2;1-4-23-19(13(2)9-22-23)18-14(6-5-7-20-18)12-26-16-10-21-17(25-3)8-15(16)11-24;1-27-16-7-13(9-26)15(8-23-16)28-10-12-3-2-5-22-17(12)14-4-6-25(24-14)11-18(19,20)21/h3-7,14-16,18H,8-13,17H2,1-2H3;4-8,11-13H,3,9-10,14H2,1-2H3;5-11H,4,12H2,1-3H3;2-9H,10-11H2,1H3.

What are the key properties of 5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde?

5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde has a molecular weight of 1578.68 g/mol, XLogP of 12.17, 34 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[[2-(1-ethyl-4-methylpyrazol-5-yl)-3-pyridinyl]methoxy]-2-methoxypyridine-4-carbaldehyde;5-[[2-(2-ethylpyrazol-3-yl)-3-pyridinyl]methoxy]-2-(2-methoxyethoxy)pyridine-4-carbaldehyde;2-methoxy-5-[[2-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]-3-pyridinyl]methoxy]pyridine-4-carbaldehyde;2-(2-morpholin-4-ylethoxy)-5-[[2-(2-propan-2-ylpyrazol-3-yl)-3-pyridinyl]methoxy]pyridine-4-carbaldehyde is sourced from PubChem (CID 158700643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).