2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide

C11H12F3N3O3 — CID 47249058

IUPAC2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide
SMILESCC(=O)N(C)CC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O
InChIInChI=1S/C11H12F3N3O3/c1-6(18)17(2)5-9(19)16-8-3-7(11(12,13)14)4-15-10(8)20/h3-4H,5H2,1-2H3,(H,15,20)(H,16,19)
InChIKeyFYHCQBNNSYFURO-UHFFFAOYSA-N
MW291.23 g/mol
LogP0.81
Rot. Bonds3

About 2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide

2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide (PubChem CID 47249058) has the molecular formula C11H12F3N3O3 and a molecular weight of 291.23 g/mol. Its IUPAC name is 2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide.

Molecular Properties

Compound Name2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide
PubChem CID47249058
Molecular FormulaC11H12F3N3O3
Molecular Weight291.23 g/mol
Exact Mass291.08
IUPAC Name2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide
SMILESCC(=O)N(C)CC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O
InChIInChI=1S/C11H12F3N3O3/c1-6(18)17(2)5-9(19)16-8-3-7(11(12,13)14)4-15-10(8)20/h3-4H,5H2,1-2H3,(H,15,20)(H,16,19)
InChIKeyFYHCQBNNSYFURO-UHFFFAOYSA-N
XLogP0.81
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.23
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-Amino-5-(trifluoromethyl)-1,2-dihydropyridin-2-one
CID 2315787
2-[3-chloro-2-oxo-5-(trifluoromethyl)-1-pyridinyl]-N-ethylacetamide
CID 2587467
N-cyclopentyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 2623831
N-(2-Oxo-5-(trifluoromethyl)-1,2-dihydropyridin-3-yl)acetamide
CID 47137243
1-butyl-3-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]urea
CID 2121670
N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)acetamide
CID 59268968
3-Amino-1-methyl-5-(trifluoromethyl)-1,2-dihydropyridin-2-one
CID 84008554
N-(ethylcarbamoyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 2633446
N-butyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 4826239
2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide
CID 7633456
2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]-N-(2,2,2-trifluoroethyl)acetamide
CID 8894228
N-methyl-6-oxo-N-(2-oxo-2-((2,2,2-trifluoroethyl)amino)ethyl)-1,6-dihydropyridine-3-carboxamide
CID 49669728

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide?
The IUPAC name of 2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide (CID 47249058) is 2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide.
What is the SMILES notation for 2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide?
The canonical SMILES for 2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide is CC(=O)N(C)CC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O.
What is the InChIKey of 2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide?
The InChIKey is FYHCQBNNSYFURO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3N3O3/c1-6(18)17(2)5-9(19)16-8-3-7(11(12,13)14)4-15-10(8)20/h3-4H,5H2,1-2H3,(H,15,20)(H,16,19).
What are the key properties of 2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide?
2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide has a molecular weight of 291.23 g/mol, XLogP of 0.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide is sourced from PubChem (CID 47249058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).