About N-(furan-2-ylmethyl)pyridine-3-carboxamide
N-(furan-2-ylmethyl)pyridine-3-carboxamide (PubChem CID 1087305) has the molecular formula C11H10N2O2
and a molecular weight of 202.21 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)pyridine-3-carboxamide.
Molecular Properties
| Compound Name | N-(furan-2-ylmethyl)pyridine-3-carboxamide |
| PubChem CID | 1087305 |
| Molecular Formula | C11H10N2O2 |
| Molecular Weight | 202.21 g/mol |
| Exact Mass | 202.07 |
| IUPAC Name | N-(furan-2-ylmethyl)pyridine-3-carboxamide |
| SMILES | O=C(NCc1ccco1)c1cccnc1 |
| InChI | InChI=1S/C11H10N2O2/c14-11(9-3-1-5-12-7-9)13-8-10-4-2-6-15-10/h1-7H,8H2,(H,13,14) |
| InChIKey | OLEYYNUSGLFIKE-UHFFFAOYSA-N |
| XLogP | 1.60 |
| TPSA | 55.13 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 202.21 |
| LogP ≤ 5 | 1.60 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-(furan-2-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)pyridine-3-carboxamide (CID 1087305) is N-(furan-2-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)pyridine-3-carboxamide is O=C(NCc1ccco1)c1cccnc1.
What is the InChIKey of N-(furan-2-ylmethyl)pyridine-3-carboxamide?
The InChIKey is OLEYYNUSGLFIKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c14-11(9-3-1-5-12-7-9)13-8-10-4-2-6-15-10/h1-7H,8H2,(H,13,14).
What are the key properties of N-(furan-2-ylmethyl)pyridine-3-carboxamide?
N-(furan-2-ylmethyl)pyridine-3-carboxamide has a molecular weight of 202.21 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 1087305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).