About N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine
N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine (PubChem CID 103228309) has the molecular formula C14H32N2O2
and a molecular weight of 260.42 g/mol. Its IUPAC name is N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine.
Molecular Properties
| Compound Name | N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine |
| PubChem CID | 103228309 |
| Molecular Formula | C14H32N2O2 |
| Molecular Weight | 260.42 g/mol |
| Exact Mass | 260.25 |
| IUPAC Name | N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine |
| SMILES | CCN(CC)CCOC(CNCC(C)C)COC |
| InChI | InChI=1S/C14H32N2O2/c1-6-16(7-2)8-9-18-14(12-17-5)11-15-10-13(3)4/h13-15H,6-12H2,1-5H3 |
| InChIKey | IPEVRZXDVVOWKK-UHFFFAOYSA-N |
| XLogP | 1.61 |
| TPSA | 33.73 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 260.42 |
| LogP ≤ 5 | 1.61 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine?
The IUPAC name of N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine (CID 103228309) is N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine is CCN(CC)CCOC(CNCC(C)C)COC.
What is the InChIKey of N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine?
The InChIKey is IPEVRZXDVVOWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2O2/c1-6-16(7-2)8-9-18-14(12-17-5)11-15-10-13(3)4/h13-15H,6-12H2,1-5H3.
What are the key properties of N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine?
N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine has a molecular weight of 260.42 g/mol, XLogP of 1.61, 12 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine is sourced from PubChem (CID 103228309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).