N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide

C25H22N2O4 — CID 8698205

IUPACN-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(=O)n(Cc3cccc4ccccc34)c2)cc1OC
InChIInChI=1S/C25H22N2O4/c1-30-22-12-11-20(14-23(22)31-2)26-25(29)19-10-13-24(28)27(16-19)15-18-8-5-7-17-6-3-4-9-21(17)18/h3-14,16H,15H2,1-2H3,(H,26,29)
InChIKeyNCZYFZWLIHCIOB-UHFFFAOYSA-N
MW414.46 g/mol
LogP4.32
Rot. Bonds6

About N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide

N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide (PubChem CID 8698205) has the molecular formula C25H22N2O4 and a molecular weight of 414.46 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide
PubChem CID8698205
Molecular FormulaC25H22N2O4
Molecular Weight414.46 g/mol
Exact Mass414.16
IUPAC NameN-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(=O)n(Cc3cccc4ccccc34)c2)cc1OC
InChIInChI=1S/C25H22N2O4/c1-30-22-12-11-20(14-23(22)31-2)26-25(29)19-10-13-24(28)27(16-19)15-18-8-5-7-17-6-3-4-9-21(17)18/h3-14,16H,15H2,1-2H3,(H,26,29)
InChIKeyNCZYFZWLIHCIOB-UHFFFAOYSA-N
XLogP4.32
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.46
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4-difluorophenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide
CID 8698182
N-(3-chloro-4-methylphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide
CID 8698220
N-(3,4-dimethoxyphenyl)-1-[(4-ethylphenyl)methyl]-6-oxopyridine-3-carboxamide
CID 110382704
N-(2,3-dimethylphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide
CID 8698190
N-(2,4-difluorophenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide
CID 8698180
1-[(2-chlorophenyl)methyl]-N-[(3,4-dimethoxyphenyl)methyl]-6-oxopyridine-3-carboxamide
CID 16573885
1-[(2-chlorophenyl)methyl]-N-(4,5-dimethoxy-2-methylphenyl)-6-oxopyridine-3-carboxamide
CID 24559729
1-[(2-chlorophenyl)methyl]-N-(2-methoxyphenyl)-6-oxopyridine-3-carboxamide
CID 8671416
N-(4-bromo-3-methylphenyl)-1-[(2-methylphenyl)methyl]-6-oxopyridine-3-carboxamide
CID 26843861
1-[(4-methoxyphenyl)methyl]-N-(3-methylphenyl)-6-oxopyridine-3-carboxamide
CID 110382997
1-[(2,5-dimethylphenyl)methyl]-N-(3-methoxyphenyl)-6-oxopyridine-3-carboxamide
CID 8671473
1-[(3-fluorophenyl)methyl]-N-(4-methoxyphenyl)-6-oxopyridine-3-carboxamide
CID 8671064

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide (CID 8698205) is N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide is COc1ccc(NC(=O)c2ccc(=O)n(Cc3cccc4ccccc34)c2)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide?
The InChIKey is NCZYFZWLIHCIOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22N2O4/c1-30-22-12-11-20(14-23(22)31-2)26-25(29)19-10-13-24(28)27(16-19)15-18-8-5-7-17-6-3-4-9-21(17)18/h3-14,16H,15H2,1-2H3,(H,26,29).
What are the key properties of N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide?
N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide has a molecular weight of 414.46 g/mol, XLogP of 4.32, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 8698205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).