4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide

C21H20N4O3 — CID 91310443

IUPAC4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILESCC(=O)Nc1cc(=O)n(Cc2cccnc2)c(C)c1C(=O)Nc1ccccc1
InChIInChI=1S/C21H20N4O3/c1-14-20(21(28)24-17-8-4-3-5-9-17)18(23-15(2)26)11-19(27)25(14)13-16-7-6-10-22-12-16/h3-12H,13H2,1-2H3,(H,23,26)(H,24,28)
InChIKeyUAFZPZVGUUVSGM-UHFFFAOYSA-N
MW376.42 g/mol
LogP2.81
Rot. Bonds5

About 4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide

4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide (PubChem CID 91310443) has the molecular formula C21H20N4O3 and a molecular weight of 376.42 g/mol. Its IUPAC name is 4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
PubChem CID91310443
Molecular FormulaC21H20N4O3
Molecular Weight376.42 g/mol
Exact Mass376.15
IUPAC Name4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILESCC(=O)Nc1cc(=O)n(Cc2cccnc2)c(C)c1C(=O)Nc1ccccc1
InChIInChI=1S/C21H20N4O3/c1-14-20(21(28)24-17-8-4-3-5-9-17)18(23-15(2)26)11-19(27)25(14)13-16-7-6-10-22-12-16/h3-12H,13H2,1-2H3,(H,23,26)(H,24,28)
InChIKeyUAFZPZVGUUVSGM-UHFFFAOYSA-N
XLogP2.81
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-ethyl-6-methyl-4-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040065
2-methyl-1-(pyridin-3-ylmethyl)indole-3-carbohydrazide
CID 91690120
1,3-dioxo-N-phenyl-2-(pyridin-3-ylmethyl)isoindole-5-carboxamide
CID 2993985
6-anilino-2-phenyl-3-(pyridin-3-ylmethyl)pyrimidin-4-one
CID 139798980
4-methyl-2-phenyl-5-(pyridin-3-ylmethyl)-1H-pyrazolo[4,3-c]pyridine-3,6-dione
CID 4112136
4-methyl-2-oxo-1-(2-phenylethyl)-N-pyridin-3-ylpyridine-3-carboxamide
CID 172656157
6-methyl-4-oxo-N-phenyl-2-pyridin-4-yl-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040319
1-[2-oxo-3-(pyridin-3-ylmethyl)quinazolin-4-yl]-3-phenylurea
CID 18585029
6-methyl-N-(2-methylphenyl)-4-oxo-2-pentyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040324
1-[(4-chlorophenyl)methyl]-6-ethyl-2-methyl-4-oxo-N-phenylpyridine-3-carboxamide
CID 23040296
2-butyl-N-(2-chlorophenyl)-6-methyl-4-oxo-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040327
oxalic acid;N-phenyl-2-(pyridin-3-ylmethylamino)acetamide
CID 175652905

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide (CID 91310443) is 4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide is CC(=O)Nc1cc(=O)n(Cc2cccnc2)c(C)c1C(=O)Nc1ccccc1.
What is the InChIKey of 4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The InChIKey is UAFZPZVGUUVSGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O3/c1-14-20(21(28)24-17-8-4-3-5-9-17)18(23-15(2)26)11-19(27)25(14)13-16-7-6-10-22-12-16/h3-12H,13H2,1-2H3,(H,23,26)(H,24,28).
What are the key properties of 4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide has a molecular weight of 376.42 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-2-methyl-6-oxo-N-phenyl-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 91310443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).