About N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine
N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine (PubChem CID 130615257) has the molecular formula C10H17NO
and a molecular weight of 167.25 g/mol. Its IUPAC name is N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine.
Molecular Properties
| Compound Name | N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine |
| PubChem CID | 130615257 |
| Molecular Formula | C10H17NO |
| Molecular Weight | 167.25 g/mol |
| Exact Mass | 167.13 |
| IUPAC Name | N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine |
| SMILES | CCN(C)C(C)c1ccc(C)o1 |
| InChI | InChI=1S/C10H17NO/c1-5-11(4)9(3)10-7-6-8(2)12-10/h6-7,9H,5H2,1-4H3 |
| InChIKey | ANSRJCHOURBDNW-UHFFFAOYSA-N |
| XLogP | 2.60 |
| TPSA | 16.38 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 167.25 |
| LogP ≤ 5 | 2.60 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine?
The IUPAC name of N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine (CID 130615257) is N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine?
The canonical SMILES for N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine is CCN(C)C(C)c1ccc(C)o1.
What is the InChIKey of N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine?
The InChIKey is ANSRJCHOURBDNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-5-11(4)9(3)10-7-6-8(2)12-10/h6-7,9H,5H2,1-4H3.
What are the key properties of N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine?
N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine has a molecular weight of 167.25 g/mol, XLogP of 2.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-1-(5-methylfuran-2-yl)ethanamine is sourced from PubChem (CID 130615257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).