About 1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine
1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine (PubChem CID 63204415) has the molecular formula C10H17NO2
and a molecular weight of 183.25 g/mol. Its IUPAC name is 1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine.
Molecular Properties
| Compound Name | 1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine |
| PubChem CID | 63204415 |
| Molecular Formula | C10H17NO2 |
| Molecular Weight | 183.25 g/mol |
| Exact Mass | 183.13 |
| IUPAC Name | 1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine |
| SMILES | CCOCC(C)NCc1ccoc1 |
| InChI | InChI=1S/C10H17NO2/c1-3-12-7-9(2)11-6-10-4-5-13-8-10/h4-5,8-9,11H,3,6-7H2,1-2H3 |
| InChIKey | BTNFPLZDBMKIBG-UHFFFAOYSA-N |
| XLogP | 1.79 |
| TPSA | 34.40 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 183.25 |
| LogP ≤ 5 | 1.79 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine?
The IUPAC name of 1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine (CID 63204415) is 1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine.
What is the SMILES notation for 1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine?
The canonical SMILES for 1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine is CCOCC(C)NCc1ccoc1.
What is the InChIKey of 1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine?
The InChIKey is BTNFPLZDBMKIBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-3-12-7-9(2)11-6-10-4-5-13-8-10/h4-5,8-9,11H,3,6-7H2,1-2H3.
What are the key properties of 1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine?
1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine has a molecular weight of 183.25 g/mol, XLogP of 1.79, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-N-(furan-3-ylmethyl)propan-2-amine is sourced from PubChem (CID 63204415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).