About N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine
N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine (PubChem CID 81067383) has the molecular formula C14H30N2O2
and a molecular weight of 258.41 g/mol. Its IUPAC name is N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine.
Molecular Properties
| Compound Name | N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine |
| PubChem CID | 81067383 |
| Molecular Formula | C14H30N2O2 |
| Molecular Weight | 258.41 g/mol |
| Exact Mass | 258.23 |
| IUPAC Name | N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine |
| SMILES | CCNCC1CCC(CN(C)CCOC(C)C)O1 |
| InChI | InChI=1S/C14H30N2O2/c1-5-15-10-13-6-7-14(18-13)11-16(4)8-9-17-12(2)3/h12-15H,5-11H2,1-4H3 |
| InChIKey | WGYRWOPWEDSHFE-UHFFFAOYSA-N |
| XLogP | 1.50 |
| TPSA | 33.73 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 258.41 |
| LogP ≤ 5 | 1.50 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine?
The IUPAC name of N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine (CID 81067383) is N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine.
What is the SMILES notation for N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine?
The canonical SMILES for N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine is CCNCC1CCC(CN(C)CCOC(C)C)O1.
What is the InChIKey of N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine?
The InChIKey is WGYRWOPWEDSHFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-5-15-10-13-6-7-14(18-13)11-16(4)8-9-17-12(2)3/h12-15H,5-11H2,1-4H3.
What are the key properties of N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine?
N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine has a molecular weight of 258.41 g/mol, XLogP of 1.50, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(ethylaminomethyl)oxolan-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine is sourced from PubChem (CID 81067383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).