2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide

C14H19F3N2O2 — CID 71968871

IUPAC2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCc1cccn(CC(=O)N(CC(C)C)CC(F)(F)F)c1=O
InChIInChI=1S/C14H19F3N2O2/c1-10(2)7-19(9-14(15,16)17)12(20)8-18-6-4-5-11(3)13(18)21/h4-6,10H,7-9H2,1-3H3
InChIKeyGWBCYIFOJJIYHE-UHFFFAOYSA-N
MW304.31 g/mol
LogP2.20
Rot. Bonds5

About 2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide

2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 71968871) has the molecular formula C14H19F3N2O2 and a molecular weight of 304.31 g/mol. Its IUPAC name is 2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID71968871
Molecular FormulaC14H19F3N2O2
Molecular Weight304.31 g/mol
Exact Mass304.14
IUPAC Name2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCc1cccn(CC(=O)N(CC(C)C)CC(F)(F)F)c1=O
InChIInChI=1S/C14H19F3N2O2/c1-10(2)7-19(9-14(15,16)17)12(20)8-18-6-4-5-11(3)13(18)21/h4-6,10H,7-9H2,1-3H3
InChIKeyGWBCYIFOJJIYHE-UHFFFAOYSA-N
XLogP2.20
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide (CID 71968871) is 2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide is Cc1cccn(CC(=O)N(CC(C)C)CC(F)(F)F)c1=O.
What is the InChIKey of 2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is GWBCYIFOJJIYHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2O2/c1-10(2)7-19(9-14(15,16)17)12(20)8-18-6-4-5-11(3)13(18)21/h4-6,10H,7-9H2,1-3H3.
What are the key properties of 2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide?
2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 304.31 g/mol, XLogP of 2.20, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 71968871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).