2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide

C7H6F3N3O — CID 66593263

IUPAC2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide
SMILESNC(=O)Cc1nccc(C(F)(F)F)n1
InChIInChI=1S/C7H6F3N3O/c8-7(9,10)4-1-2-12-6(13-4)3-5(11)14/h1-2H,3H2,(H2,11,14)
InChIKeyLZCBTSNFJIXFRS-UHFFFAOYSA-N
MW205.14 g/mol
LogP0.52
Rot. Bonds2

About 2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide

2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide (PubChem CID 66593263) has the molecular formula C7H6F3N3O and a molecular weight of 205.14 g/mol. Its IUPAC name is 2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide.

Molecular Properties

Compound Name2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide
PubChem CID66593263
Molecular FormulaC7H6F3N3O
Molecular Weight205.14 g/mol
Exact Mass205.05
IUPAC Name2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide
SMILESNC(=O)Cc1nccc(C(F)(F)F)n1
InChIInChI=1S/C7H6F3N3O/c8-7(9,10)4-1-2-12-6(13-4)3-5(11)14/h1-2H,3H2,(H2,11,14)
InChIKeyLZCBTSNFJIXFRS-UHFFFAOYSA-N
XLogP0.52
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.14
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide?
The IUPAC name of 2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide (CID 66593263) is 2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide.
What is the SMILES notation for 2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide?
The canonical SMILES for 2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide is NC(=O)Cc1nccc(C(F)(F)F)n1.
What is the InChIKey of 2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide?
The InChIKey is LZCBTSNFJIXFRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F3N3O/c8-7(9,10)4-1-2-12-6(13-4)3-5(11)14/h1-2H,3H2,(H2,11,14).
What are the key properties of 2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide?
2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide has a molecular weight of 205.14 g/mol, XLogP of 0.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(trifluoromethyl)pyrimidin-2-yl]acetamide is sourced from PubChem (CID 66593263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).