N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide

C22H20N2O5 — CID 110382398

IUPACN-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide
SMILESCOc1cccc(COn2cccc(C(=O)Nc3ccccc3C(C)=O)c2=O)c1
InChIInChI=1S/C22H20N2O5/c1-15(25)18-9-3-4-11-20(18)23-21(26)19-10-6-12-24(22(19)27)29-14-16-7-5-8-17(13-16)28-2/h3-13H,14H2,1-2H3,(H,23,26)
InChIKeyIXADOBWZPMZLKO-UHFFFAOYSA-N
MW392.41 g/mol
LogP2.94
Rot. Bonds7

About N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide

N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide (PubChem CID 110382398) has the molecular formula C22H20N2O5 and a molecular weight of 392.41 g/mol. Its IUPAC name is N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide
PubChem CID110382398
Molecular FormulaC22H20N2O5
Molecular Weight392.41 g/mol
Exact Mass392.14
IUPAC NameN-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide
SMILESCOc1cccc(COn2cccc(C(=O)Nc3ccccc3C(C)=O)c2=O)c1
InChIInChI=1S/C22H20N2O5/c1-15(25)18-9-3-4-11-20(18)23-21(26)19-10-6-12-24(22(19)27)29-14-16-7-5-8-17(13-16)28-2/h3-13H,14H2,1-2H3,(H,23,26)
InChIKeyIXADOBWZPMZLKO-UHFFFAOYSA-N
XLogP2.94
TPSA86.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.41
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide (CID 110382398) is N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide is COc1cccc(COn2cccc(C(=O)Nc3ccccc3C(C)=O)c2=O)c1.
What is the InChIKey of N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide?
The InChIKey is IXADOBWZPMZLKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O5/c1-15(25)18-9-3-4-11-20(18)23-21(26)19-10-6-12-24(22(19)27)29-14-16-7-5-8-17(13-16)28-2/h3-13H,14H2,1-2H3,(H,23,26).
What are the key properties of N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide?
N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide has a molecular weight of 392.41 g/mol, XLogP of 2.94, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 110382398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).