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

C22H20N2O4 — CID 110382768

IUPACN-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide
SMILESCC(=O)c1ccccc1NC(=O)c1cccn(OCc2cccc(C)c2)c1=O
InChIInChI=1S/C22H20N2O4/c1-15-7-5-8-17(13-15)14-28-24-12-6-10-19(22(24)27)21(26)23-20-11-4-3-9-18(20)16(2)25/h3-13H,14H2,1-2H3,(H,23,26)
InChIKeyMDFJNWBPHGPKGE-UHFFFAOYSA-N
MW376.41 g/mol
LogP3.24
Rot. Bonds6

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

N-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide (PubChem CID 110382768) has the molecular formula C22H20N2O4 and a molecular weight of 376.41 g/mol. Its IUPAC name is N-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide
PubChem CID110382768
Molecular FormulaC22H20N2O4
Molecular Weight376.41 g/mol
Exact Mass376.14
IUPAC NameN-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide
SMILESCC(=O)c1ccccc1NC(=O)c1cccn(OCc2cccc(C)c2)c1=O
InChIInChI=1S/C22H20N2O4/c1-15-7-5-8-17(13-15)14-28-24-12-6-10-19(22(24)27)21(26)23-20-11-4-3-9-18(20)16(2)25/h3-13H,14H2,1-2H3,(H,23,26)
InChIKeyMDFJNWBPHGPKGE-UHFFFAOYSA-N
XLogP3.24
TPSA77.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.41
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide (CID 110382768) is N-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide is CC(=O)c1ccccc1NC(=O)c1cccn(OCc2cccc(C)c2)c1=O.
What is the InChIKey of N-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide?
The InChIKey is MDFJNWBPHGPKGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O4/c1-15-7-5-8-17(13-15)14-28-24-12-6-10-19(22(24)27)21(26)23-20-11-4-3-9-18(20)16(2)25/h3-13H,14H2,1-2H3,(H,23,26).
What are the key properties of N-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide?
N-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide has a molecular weight of 376.41 g/mol, XLogP of 3.24, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-1-[(3-methylphenyl)methoxy]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 110382768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).