2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide

C17H17F3N2O3 — CID 6488675

IUPAC2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide
SMILESCOCC(=O)Nc1cc(C)cn(Cc2cccc(C(F)(F)F)c2)c1=O
InChIInChI=1S/C17H17F3N2O3/c1-11-6-14(21-15(23)10-25-2)16(24)22(8-11)9-12-4-3-5-13(7-12)17(18,19)20/h3-8H,9-10H2,1-2H3,(H,21,23)
InChIKeyMAWCSGNZMOHYLL-UHFFFAOYSA-N
MW354.33 g/mol
LogP2.81
Rot. Bonds5

About 2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide

2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide (PubChem CID 6488675) has the molecular formula C17H17F3N2O3 and a molecular weight of 354.33 g/mol. Its IUPAC name is 2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide
PubChem CID6488675
Molecular FormulaC17H17F3N2O3
Molecular Weight354.33 g/mol
Exact Mass354.12
IUPAC Name2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide
SMILESCOCC(=O)Nc1cc(C)cn(Cc2cccc(C(F)(F)F)c2)c1=O
InChIInChI=1S/C17H17F3N2O3/c1-11-6-14(21-15(23)10-25-2)16(24)22(8-11)9-12-4-3-5-13(7-12)17(18,19)20/h3-8H,9-10H2,1-2H3,(H,21,23)
InChIKeyMAWCSGNZMOHYLL-UHFFFAOYSA-N
XLogP2.81
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.33
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[(4-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide
CID 6488633
N-[1-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-2-oxo-3-pyridinyl]-2-methoxyacetamide
CID 6488653
2-methoxy-N-[5-[1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-3-yl]-1H-pyrazol-4-yl]acetamide
CID 75474520
methyl 2-[4-hydroxy-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetate
CID 54675993
N-(2,6-dimethylphenyl)-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide
CID 7598829
N-(2,6-dimethylphenyl)-6-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide
CID 8697298
2-methoxy-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]acetamide
CID 51328951
5-bromo-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxylate
CID 7062253
2,4-dioxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyrimidine-5-carboxylic acid
CID 115114703
N-(4-acetamidophenyl)-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide
CID 26843705
N-[5-methyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-3-yl]butanamide
CID 19392878
3-(2,4-dimethylphenyl)-1-(2-methoxyethyl)-1-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrrol-2-yl]methyl]urea
CID 4004296

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide?
The IUPAC name of 2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide (CID 6488675) is 2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide?
The canonical SMILES for 2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide is COCC(=O)Nc1cc(C)cn(Cc2cccc(C(F)(F)F)c2)c1=O.
What is the InChIKey of 2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide?
The InChIKey is MAWCSGNZMOHYLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F3N2O3/c1-11-6-14(21-15(23)10-25-2)16(24)22(8-11)9-12-4-3-5-13(7-12)17(18,19)20/h3-8H,9-10H2,1-2H3,(H,21,23).
What are the key properties of 2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide?
2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide has a molecular weight of 354.33 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[5-methyl-2-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-3-pyridinyl]acetamide is sourced from PubChem (CID 6488675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).