2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide

C10H11F3N2O2 — CID 72886293

IUPAC2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide
SMILESCc1cc(C(F)(F)F)cc(=O)n1C(C)C(N)=O
InChIInChI=1S/C10H11F3N2O2/c1-5-3-7(10(11,12)13)4-8(16)15(5)6(2)9(14)17/h3-4,6H,1-2H3,(H2,14,17)
InChIKeyLOOKRUVKEXOHGN-UHFFFAOYSA-N
MW248.20 g/mol
LogP1.22
Rot. Bonds2

About 2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide

2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide (PubChem CID 72886293) has the molecular formula C10H11F3N2O2 and a molecular weight of 248.20 g/mol. Its IUPAC name is 2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide.

Molecular Properties

Compound Name2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide
PubChem CID72886293
Molecular FormulaC10H11F3N2O2
Molecular Weight248.20 g/mol
Exact Mass248.08
IUPAC Name2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide
SMILESCc1cc(C(F)(F)F)cc(=O)n1C(C)C(N)=O
InChIInChI=1S/C10H11F3N2O2/c1-5-3-7(10(11,12)13)4-8(16)15(5)6(2)9(14)17/h3-4,6H,1-2H3,(H2,14,17)
InChIKeyLOOKRUVKEXOHGN-UHFFFAOYSA-N
XLogP1.22
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.20
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide?
The IUPAC name of 2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide (CID 72886293) is 2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide.
What is the SMILES notation for 2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide?
The canonical SMILES for 2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide is Cc1cc(C(F)(F)F)cc(=O)n1C(C)C(N)=O.
What is the InChIKey of 2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide?
The InChIKey is LOOKRUVKEXOHGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O2/c1-5-3-7(10(11,12)13)4-8(16)15(5)6(2)9(14)17/h3-4,6H,1-2H3,(H2,14,17).
What are the key properties of 2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide?
2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide has a molecular weight of 248.20 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]propanamide is sourced from PubChem (CID 72886293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).