About 2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine
2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine (PubChem CID 105177427) has the molecular formula C13H16N2O2
and a molecular weight of 232.28 g/mol. Its IUPAC name is 2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine.
Molecular Properties
| Compound Name | 2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine |
| PubChem CID | 105177427 |
| Molecular Formula | C13H16N2O2 |
| Molecular Weight | 232.28 g/mol |
| Exact Mass | 232.12 |
| IUPAC Name | 2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine |
| SMILES | CNC(Cc1ccco1)c1cccnc1OC |
| InChI | InChI=1S/C13H16N2O2/c1-14-12(9-10-5-4-8-17-10)11-6-3-7-15-13(11)16-2/h3-8,12,14H,9H2,1-2H3 |
| InChIKey | MOWOHFORFCPEIT-UHFFFAOYSA-N |
| XLogP | 2.19 |
| TPSA | 47.29 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 232.28 |
| LogP ≤ 5 | 2.19 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine?
The IUPAC name of 2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine (CID 105177427) is 2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine.
What is the SMILES notation for 2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine?
The canonical SMILES for 2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine is CNC(Cc1ccco1)c1cccnc1OC.
What is the InChIKey of 2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine?
The InChIKey is MOWOHFORFCPEIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-14-12(9-10-5-4-8-17-10)11-6-3-7-15-13(11)16-2/h3-8,12,14H,9H2,1-2H3.
What are the key properties of 2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine?
2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine has a molecular weight of 232.28 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine is sourced from PubChem (CID 105177427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).