About N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide
N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide (PubChem CID 168526932) has the molecular formula C16H12N2O2
and a molecular weight of 264.28 g/mol. Its IUPAC name is N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide.
Molecular Properties
| Compound Name | N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide |
| PubChem CID | 168526932 |
| Molecular Formula | C16H12N2O2 |
| Molecular Weight | 264.28 g/mol |
| Exact Mass | 264.09 |
| IUPAC Name | N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide |
| SMILES | O=C(Nc1ccc(-c2ccco2)cc1)c1cccnc1 |
| InChI | InChI=1S/C16H12N2O2/c19-16(13-3-1-9-17-11-13)18-14-7-5-12(6-8-14)15-4-2-10-20-15/h1-11H,(H,18,19) |
| InChIKey | QXDXDAIJAXHFLY-UHFFFAOYSA-N |
| XLogP | 3.59 |
| TPSA | 55.13 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 264.28 |
| LogP ≤ 5 | 3.59 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide (CID 168526932) is N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide is O=C(Nc1ccc(-c2ccco2)cc1)c1cccnc1.
What is the InChIKey of N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide?
The InChIKey is QXDXDAIJAXHFLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2/c19-16(13-3-1-9-17-11-13)18-14-7-5-12(6-8-14)15-4-2-10-20-15/h1-11H,(H,18,19).
What are the key properties of N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide?
N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide has a molecular weight of 264.28 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-yl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 168526932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).