N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide

C12H12N2O3 — CID 18116946

IUPACN-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
SMILESCC(NC(=O)c1ccc[nH]c1=O)c1ccco1
InChIInChI=1S/C12H12N2O3/c1-8(10-5-3-7-17-10)14-12(16)9-4-2-6-13-11(9)15/h2-8H,1H3,(H,13,15)(H,14,16)
InChIKeyKSBNSVITUHCXDK-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.46
Rot. Bonds3

About N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide

N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 18116946) has the molecular formula C12H12N2O3 and a molecular weight of 232.24 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
PubChem CID18116946
Molecular FormulaC12H12N2O3
Molecular Weight232.24 g/mol
Exact Mass232.08
IUPAC NameN-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
SMILESCC(NC(=O)c1ccc[nH]c1=O)c1ccco1
InChIInChI=1S/C12H12N2O3/c1-8(10-5-3-7-17-10)14-12(16)9-4-2-6-13-11(9)15/h2-8H,1H3,(H,13,15)(H,14,16)
InChIKeyKSBNSVITUHCXDK-UHFFFAOYSA-N
XLogP1.46
TPSA75.10 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(furan-2-yl)ethyl]-1H-indole-4-carboxamide
CID 43581973
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CID 95976314
N-[(2S)-1-(furan-2-yl)propan-2-yl]-2-oxo-1H-pyridine-3-carboxamide
CID 94022833
N-[(1S)-1-(furan-2-yl)ethyl]-2-(methylamino)benzamide
CID 81399463
2-chloro-N-[1-(furan-2-yl)ethyl]benzamide
CID 18116836
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 25443183
2-(ethylamino)-N-[1-(furan-2-yl)ethyl]benzamide
CID 62169362
N-but-3-yn-2-yl-2-oxo-1H-pyridine-3-carboxamide
CID 114418972
N-[1-(2,5-dimethylphenyl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 17495468
3-hydroxy-2-[(2-oxo-1H-pyridine-3-carbonyl)amino]butanoic acid
CID 24704137
2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide
CID 62073819
N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 18143629

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide (CID 18116946) is N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide is CC(NC(=O)c1ccc[nH]c1=O)c1ccco1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is KSBNSVITUHCXDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3/c1-8(10-5-3-7-17-10)14-12(16)9-4-2-6-13-11(9)15/h2-8H,1H3,(H,13,15)(H,14,16).
What are the key properties of N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide?
N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 232.24 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 18116946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).