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

C22H22N2O4 — CID 110382730

IUPACN-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide
SMILESCOc1cccc(COn2cccc(C(=O)Nc3cccc(C)c3C)c2=O)c1
InChIInChI=1S/C22H22N2O4/c1-15-7-4-11-20(16(15)2)23-21(25)19-10-6-12-24(22(19)26)28-14-17-8-5-9-18(13-17)27-3/h4-13H,14H2,1-3H3,(H,23,25)
InChIKeyRKCHKPDVBSHGAF-UHFFFAOYSA-N
MW378.43 g/mol
LogP3.35
Rot. Bonds6

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

N-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide (PubChem CID 110382730) has the molecular formula C22H22N2O4 and a molecular weight of 378.43 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide
PubChem CID110382730
Molecular FormulaC22H22N2O4
Molecular Weight378.43 g/mol
Exact Mass378.16
IUPAC NameN-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide
SMILESCOc1cccc(COn2cccc(C(=O)Nc3cccc(C)c3C)c2=O)c1
InChIInChI=1S/C22H22N2O4/c1-15-7-4-11-20(16(15)2)23-21(25)19-10-6-12-24(22(19)26)28-14-17-8-5-9-18(13-17)27-3/h4-13H,14H2,1-3H3,(H,23,25)
InChIKeyRKCHKPDVBSHGAF-UHFFFAOYSA-N
XLogP3.35
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.43
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide (CID 110382730) is N-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide is COc1cccc(COn2cccc(C(=O)Nc3cccc(C)c3C)c2=O)c1.
What is the InChIKey of N-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide?
The InChIKey is RKCHKPDVBSHGAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O4/c1-15-7-4-11-20(16(15)2)23-21(25)19-10-6-12-24(22(19)26)28-14-17-8-5-9-18(13-17)27-3/h4-13H,14H2,1-3H3,(H,23,25).
What are the key properties of N-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide?
N-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide has a molecular weight of 378.43 g/mol, XLogP of 3.35, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 110382730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).