About N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide
N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide (PubChem CID 103874401) has the molecular formula C16H11FN2O2
and a molecular weight of 282.27 g/mol. Its IUPAC name is N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide.
Molecular Properties
| Compound Name | N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide |
| PubChem CID | 103874401 |
| Molecular Formula | C16H11FN2O2 |
| Molecular Weight | 282.27 g/mol |
| Exact Mass | 282.08 |
| IUPAC Name | N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide |
| SMILES | O=C(Nc1ccncc1F)c1ccc2ccccc2c1O |
| InChI | InChI=1S/C16H11FN2O2/c17-13-9-18-8-7-14(13)19-16(21)12-6-5-10-3-1-2-4-11(10)15(12)20/h1-9,20H,(H,18,19,21) |
| InChIKey | YXCKXNIFHBZRTG-UHFFFAOYSA-N |
| XLogP | 3.33 |
| TPSA | 62.22 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 282.27 |
| LogP ≤ 5 | 3.33 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide?
The IUPAC name of N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide (CID 103874401) is N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide?
The canonical SMILES for N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide is O=C(Nc1ccncc1F)c1ccc2ccccc2c1O.
What is the InChIKey of N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide?
The InChIKey is YXCKXNIFHBZRTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN2O2/c17-13-9-18-8-7-14(13)19-16(21)12-6-5-10-3-1-2-4-11(10)15(12)20/h1-9,20H,(H,18,19,21).
What are the key properties of N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide?
N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide has a molecular weight of 282.27 g/mol, XLogP of 3.33, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 103874401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).