N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide

C21H19FN2O2 — CID 26844020

IUPACN-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide
SMILESCCc1ccccc1NC(=O)c1ccc(=O)n(Cc2ccccc2F)c1
InChIInChI=1S/C21H19FN2O2/c1-2-15-7-4-6-10-19(15)23-21(26)17-11-12-20(25)24(14-17)13-16-8-3-5-9-18(16)22/h3-12,14H,2,13H2,1H3,(H,23,26)
InChIKeyDGRHDYJHDULPMB-UHFFFAOYSA-N
MW350.39 g/mol
LogP3.85
Rot. Bonds5

About N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide

N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide (PubChem CID 26844020) has the molecular formula C21H19FN2O2 and a molecular weight of 350.39 g/mol. Its IUPAC name is N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide
PubChem CID26844020
Molecular FormulaC21H19FN2O2
Molecular Weight350.39 g/mol
Exact Mass350.14
IUPAC NameN-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide
SMILESCCc1ccccc1NC(=O)c1ccc(=O)n(Cc2ccccc2F)c1
InChIInChI=1S/C21H19FN2O2/c1-2-15-7-4-6-10-19(15)23-21(26)17-11-12-20(25)24(14-17)13-16-8-3-5-9-18(16)22/h3-12,14H,2,13H2,1H3,(H,23,26)
InChIKeyDGRHDYJHDULPMB-UHFFFAOYSA-N
XLogP3.85
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.39
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chlorophenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide
CID 26844026
1-[(2-chloro-6-fluorophenyl)methyl]-N-(2-ethylphenyl)-6-oxopyridine-3-carboxamide
CID 26843899
N-(2-ethylphenyl)-1-[(3-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide
CID 8671048
1-benzyl-N-(2-fluorophenyl)-6-oxopyridine-3-carboxamide
CID 8670963
N-(2,4-difluorophenyl)-1-[(2-methylphenyl)methyl]-6-oxopyridine-3-carboxamide
CID 8671220
1-[(2-fluorophenyl)methyl]-N-[4-fluoro-3-(trifluoromethyl)phenyl]-6-oxopyridine-3-carboxamide
CID 26844062
N-(2,4-difluorophenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide
CID 8698180
3-N-(2-ethylphenyl)-1-N-[(2-fluorophenyl)methyl]benzene-1,3-dicarboxamide
CID 109054619
N-(2,3-dimethylphenyl)-1-(naphthalen-1-ylmethyl)-6-oxopyridine-3-carboxamide
CID 8698190
1-[(2-chlorophenyl)methyl]-N-(2-methoxyphenyl)-6-oxopyridine-3-carboxamide
CID 8671416
1-N-(2,4-difluorophenyl)-4-N-(2-ethylphenyl)benzene-1,4-dicarboxamide
CID 109049743
5-N-(2-ethylphenyl)-3-N-[(2-fluorophenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105539

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide (CID 26844020) is N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide is CCc1ccccc1NC(=O)c1ccc(=O)n(Cc2ccccc2F)c1.
What is the InChIKey of N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide?
The InChIKey is DGRHDYJHDULPMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN2O2/c1-2-15-7-4-6-10-19(15)23-21(26)17-11-12-20(25)24(14-17)13-16-8-3-5-9-18(16)22/h3-12,14H,2,13H2,1H3,(H,23,26).
What are the key properties of N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide?
N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide has a molecular weight of 350.39 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-1-[(2-fluorophenyl)methyl]-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 26844020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).