About N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine
N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine (PubChem CID 66447023) has the molecular formula C16H19FN2
and a molecular weight of 258.34 g/mol. Its IUPAC name is N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine.
Molecular Properties
| Compound Name | N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine |
| PubChem CID | 66447023 |
| Molecular Formula | C16H19FN2 |
| Molecular Weight | 258.34 g/mol |
| Exact Mass | 258.15 |
| IUPAC Name | N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine |
| SMILES | CCNC(c1ccccc1F)C(C)c1ccccn1 |
| InChI | InChI=1S/C16H19FN2/c1-3-18-16(13-8-4-5-9-14(13)17)12(2)15-10-6-7-11-19-15/h4-12,16,18H,3H2,1-2H3 |
| InChIKey | VCBFMGRMOFAXHX-UHFFFAOYSA-N |
| XLogP | 3.67 |
| TPSA | 24.92 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 258.34 |
| LogP ≤ 5 | 3.67 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine?
The IUPAC name of N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine (CID 66447023) is N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine?
The canonical SMILES for N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine is CCNC(c1ccccc1F)C(C)c1ccccn1.
What is the InChIKey of N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine?
The InChIKey is VCBFMGRMOFAXHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2/c1-3-18-16(13-8-4-5-9-14(13)17)12(2)15-10-6-7-11-19-15/h4-12,16,18H,3H2,1-2H3.
What are the key properties of N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine?
N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine has a molecular weight of 258.34 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 66447023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).