N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide

C11H10N2O3 — CID 47285387

IUPACN-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NCc1ccoc1)c1ccc[nH]c1=O
InChIInChI=1S/C11H10N2O3/c14-10-9(2-1-4-12-10)11(15)13-6-8-3-5-16-7-8/h1-5,7H,6H2,(H,12,14)(H,13,15)
InChIKeyOVNOLHVPJWRIDT-UHFFFAOYSA-N
MW218.21 g/mol
LogP0.90
Rot. Bonds3

About N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide

N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 47285387) has the molecular formula C11H10N2O3 and a molecular weight of 218.21 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID47285387
Molecular FormulaC11H10N2O3
Molecular Weight218.21 g/mol
Exact Mass218.07
IUPAC NameN-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NCc1ccoc1)c1ccc[nH]c1=O
InChIInChI=1S/C11H10N2O3/c14-10-9(2-1-4-12-10)11(15)13-6-8-3-5-16-7-8/h1-5,7H,6H2,(H,12,14)(H,13,15)
InChIKeyOVNOLHVPJWRIDT-UHFFFAOYSA-N
XLogP0.90
TPSA75.10 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide (CID 47285387) is N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide is O=C(NCc1ccoc1)c1ccc[nH]c1=O.
What is the InChIKey of N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is OVNOLHVPJWRIDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O3/c14-10-9(2-1-4-12-10)11(15)13-6-8-3-5-16-7-8/h1-5,7H,6H2,(H,12,14)(H,13,15).
What are the key properties of N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide?
N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 218.21 g/mol, XLogP of 0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 47285387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).