About 2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol
2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol (PubChem CID 60980971) has the molecular formula C15H25NO4
and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol.
Molecular Properties
| Compound Name | 2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol |
| PubChem CID | 60980971 |
| Molecular Formula | C15H25NO4 |
| Molecular Weight | 283.37 g/mol |
| Exact Mass | 283.18 |
| IUPAC Name | 2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol |
| SMILES | COCCN(CCOC)CC(O)c1ccc(OC)cc1 |
| InChI | InChI=1S/C15H25NO4/c1-18-10-8-16(9-11-19-2)12-15(17)13-4-6-14(20-3)7-5-13/h4-7,15,17H,8-12H2,1-3H3 |
| InChIKey | INVUGZJZWHPUPY-UHFFFAOYSA-N |
| XLogP | 1.32 |
| TPSA | 51.16 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 283.37 |
| LogP ≤ 5 | 1.32 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol?
The IUPAC name of 2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol (CID 60980971) is 2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol.
What is the SMILES notation for 2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol?
The canonical SMILES for 2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol is COCCN(CCOC)CC(O)c1ccc(OC)cc1.
What is the InChIKey of 2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol?
The InChIKey is INVUGZJZWHPUPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO4/c1-18-10-8-16(9-11-19-2)12-15(17)13-4-6-14(20-3)7-5-13/h4-7,15,17H,8-12H2,1-3H3.
What are the key properties of 2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol?
2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol has a molecular weight of 283.37 g/mol, XLogP of 1.32, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol is sourced from PubChem (CID 60980971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).