N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide

C20H20N2O4 — CID 56804875

IUPACN-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCCOc1ccc(CNC(=O)c2ccc(-c3ccco3)[nH]c2=O)cc1C
InChIInChI=1S/C20H20N2O4/c1-3-25-17-9-6-14(11-13(17)2)12-21-19(23)15-7-8-16(22-20(15)24)18-5-4-10-26-18/h4-11H,3,12H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyJDNPZHYEDYZDGB-UHFFFAOYSA-N
MW352.39 g/mol
LogP3.27
Rot. Bonds6

About N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide

N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 56804875) has the molecular formula C20H20N2O4 and a molecular weight of 352.39 g/mol. Its IUPAC name is N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID56804875
Molecular FormulaC20H20N2O4
Molecular Weight352.39 g/mol
Exact Mass352.14
IUPAC NameN-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCCOc1ccc(CNC(=O)c2ccc(-c3ccco3)[nH]c2=O)cc1C
InChIInChI=1S/C20H20N2O4/c1-3-25-17-9-6-14(11-13(17)2)12-21-19(23)15-7-8-16(22-20(15)24)18-5-4-10-26-18/h4-11H,3,12H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyJDNPZHYEDYZDGB-UHFFFAOYSA-N
XLogP3.27
TPSA84.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-ethoxy-3-methylphenyl)methyl]furan-2-carboxamide
CID 110781919
N-[(4-ethoxy-3-methoxyphenyl)methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 55762586
N-(3-aminobutyl)-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide
CID 119495794
6-(furan-2-yl)-N-(3-methylbutyl)-2-oxo-1H-pyridine-3-carboxamide
CID 47459019
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide
CID 95977473
N-[(4-ethoxy-3-methylphenyl)methyl]-3-methoxybenzamide
CID 110781923
N-[2-(cycloheptylamino)ethyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide;hydrochloride
CID 119619648
N-[[(7R)-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide
CID 95977432
N-[(3,4-dimethoxyphenyl)methyl]-2-oxo-6-(4-phenylphenyl)-1H-pyridine-3-carboxamide
CID 66497970
2-[[6-(furan-2-yl)-2-oxo-1H-pyridine-3-carbonyl]amino]-2-methylpentanoic acid
CID 120517072
6-(furan-2-yl)-2-oxo-N-(2-piperazin-1-ylethyl)-1H-pyridine-3-carboxamide
CID 119445716
6-(furan-2-yl)-N-[(2R)-2-methyl-3-pyrazol-1-ylpropyl]-2-oxo-1H-pyridine-3-carboxamide
CID 95977420

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide (CID 56804875) is N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide is CCOc1ccc(CNC(=O)c2ccc(-c3ccco3)[nH]c2=O)cc1C.
What is the InChIKey of N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is JDNPZHYEDYZDGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4/c1-3-25-17-9-6-14(11-13(17)2)12-21-19(23)15-7-8-16(22-20(15)24)18-5-4-10-26-18/h4-11H,3,12H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide?
N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 352.39 g/mol, XLogP of 3.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethoxy-3-methylphenyl)methyl]-6-(furan-2-yl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 56804875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).