About 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide
2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide (PubChem CID 107709590) has the molecular formula C14H14N2O3
and a molecular weight of 258.28 g/mol. Its IUPAC name is 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide.
Molecular Properties
| Compound Name | 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide |
| PubChem CID | 107709590 |
| Molecular Formula | C14H14N2O3 |
| Molecular Weight | 258.28 g/mol |
| Exact Mass | 258.10 |
| IUPAC Name | 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide |
| SMILES | NC(=O)c1cccnc1Oc1ccc(CCO)cc1 |
| InChI | InChI=1S/C14H14N2O3/c15-13(18)12-2-1-8-16-14(12)19-11-5-3-10(4-6-11)7-9-17/h1-6,8,17H,7,9H2,(H2,15,18) |
| InChIKey | NGYNCCSEHZDOQZ-UHFFFAOYSA-N |
| XLogP | 1.51 |
| TPSA | 85.44 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 258.28 |
| LogP ≤ 5 | 1.51 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide?
The IUPAC name of 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide (CID 107709590) is 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide.
What is the SMILES notation for 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide?
The canonical SMILES for 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide is NC(=O)c1cccnc1Oc1ccc(CCO)cc1.
What is the InChIKey of 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide?
The InChIKey is NGYNCCSEHZDOQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c15-13(18)12-2-1-8-16-14(12)19-11-5-3-10(4-6-11)7-9-17/h1-6,8,17H,7,9H2,(H2,15,18).
What are the key properties of 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide?
2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide is sourced from PubChem (CID 107709590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).