N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine

C52H84FN9O6Si2 — CID 158334364

About N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine

N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine (PubChem CID 158334364) has the molecular formula C52H84FN9O6Si2 and a molecular weight of 1006.47 g/mol. Its IUPAC name is N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine.

Molecular Properties

• Compound Name: N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine
• PubChem CID: 158334364
• Molecular Formula: C52H84FN9O6Si2
• Molecular Weight: 1006.47 g/mol
• Exact Mass: 1005.61
• IUPAC Name: N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine
• SMILES: CCN(CC)CC.CCOc1ccc2c(c1)c(-c1ccnc(F)c1)nn2COCC[Si](C)(C)C.CCOc1ccc2c(c1)c(-c1ccnc(NCCOC)c1)nn2COCC[Si](C)(C)C.COCCN
• InChI: InChI=1S/C23H34N4O3Si.C20H26FN3O2Si.C6H15N.C3H9NO/c1-6-30-19-7-8-21-20(16-19)23(26-27(21)17-29-13-14-31(3,4)5)18-9-10-24-22(15-18)25-11-12-28-2;1-5-26-16-6-7-18-17(13-16)20(15-8-9-22-19(21)12-15)23-24(18)14-25-10-11-27(2,3)4;1-4-7(5-2)6-3;1-5-3-2-4/h7-10,15-16H,6,11-14,17H2,1-5H3,(H,24,25);6-9,12-13H,5,10-11,14H2,1-4H3;4-6H2,1-3H3;2-4H2,1H3
• InChIKey: GQJYYNPIDZZRDO-UHFFFAOYSA-N
• XLogP: 10.76
• TPSA: 158.09 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 15
• Rotatable Bonds: 25
• Heavy Atoms: 70
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1006.47
LogP ≤ 5	10.76
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine?

The IUPAC name of N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine (CID 158334364) is N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine.

What is the SMILES notation for N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine?

The canonical SMILES for N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine is CCN(CC)CC.CCOc1ccc2c(c1)c(-c1ccnc(F)c1)nn2COCC[Si](C)(C)C.CCOc1ccc2c(c1)c(-c1ccnc(NCCOC)c1)nn2COCC[Si](C)(C)C.COCCN.

What is the InChIKey of N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine?

The InChIKey is GQJYYNPIDZZRDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N4O3Si.C20H26FN3O2Si.C6H15N.C3H9NO/c1-6-30-19-7-8-21-20(16-19)23(26-27(21)17-29-13-14-31(3,4)5)18-9-10-24-22(15-18)25-11-12-28-2;1-5-26-16-6-7-18-17(13-16)20(15-8-9-22-19(21)12-15)23-24(18)14-25-10-11-27(2,3)4;1-4-7(5-2)6-3;1-5-3-2-4/h7-10,15-16H,6,11-14,17H2,1-5H3,(H,24,25);6-9,12-13H,5,10-11,14H2,1-4H3;4-6H2,1-3H3;2-4H2,1H3.

What are the key properties of N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine?

N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine has a molecular weight of 1006.47 g/mol, XLogP of 10.76, 25 rotatable bonds, 2 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-diethylethanamine;2-[[5-ethoxy-3-(2-fluoro-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[5-ethoxy-1-(2-trimethylsilylethoxymethyl)indazol-3-yl]-N-(2-methoxyethyl)pyridin-2-amine;2-methoxyethanamine is sourced from PubChem (CID 158334364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).