2,2,2-trifluoro-N-pyridin-4-ylacetamide

C7H5F3N2O — CID 4095205

IUPAC2,2,2-trifluoro-N-pyridin-4-ylacetamide
SMILESO=C(Nc1ccncc1)C(F)(F)F
InChIInChI=1S/C7H5F3N2O/c8-7(9,10)6(13)12-5-1-3-11-4-2-5/h1-4H,(H,11,12,13)
InChIKeyWQSUOLIZDLLWDZ-UHFFFAOYSA-N
MW190.12 g/mol
LogP1.58
Rot. Bonds1

About 2,2,2-trifluoro-N-pyridin-4-ylacetamide

2,2,2-trifluoro-N-pyridin-4-ylacetamide (PubChem CID 4095205) has the molecular formula C7H5F3N2O and a molecular weight of 190.12 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-pyridin-4-ylacetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-pyridin-4-ylacetamide
PubChem CID4095205
Molecular FormulaC7H5F3N2O
Molecular Weight190.12 g/mol
Exact Mass190.04
IUPAC Name2,2,2-trifluoro-N-pyridin-4-ylacetamide
SMILESO=C(Nc1ccncc1)C(F)(F)F
InChIInChI=1S/C7H5F3N2O/c8-7(9,10)6(13)12-5-1-3-11-4-2-5/h1-4H,(H,11,12,13)
InChIKeyWQSUOLIZDLLWDZ-UHFFFAOYSA-N
XLogP1.58
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.12
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,2,2-trifluoro-N-pyridin-4-ylacetamide with MolForge

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

Launch Full Analysis

Related Compounds

2,2,2-trifluoro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]acetamide
CID 5013683
2,2,2-tribromo-N-pyridin-4-ylacetamide
CID 23576873
4-[(2,2,2-trifluoroacetyl)amino]phenolate
CID 171407160
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-N-pyridin-4-yloctanamide
CID 15164357
4-[(2,2,2-trifluoroacetyl)amino]pyridine-2-carboxylic acid
CID 63651413
[4-[(2,2,2-trifluoroacetyl)amino]phenyl]carbamic acid
CID 18543052
2,2,2-trifluoro-N-(1-pyridin-4-ylpyrazol-4-yl)acetamide
CID 110470975
2,2,2-trifluoro-N-(4-imidazol-1-ylphenyl)acetamide
CID 110470971
2,2,2-trifluoro-N-[4-[[4-[(2,2,2-trifluoroacetyl)amino]phenyl]methyl]phenyl]acetamide
CID 3688505
3-chloro-2,2-dimethyl-N-pyridin-4-ylpropanamide
CID 63680701
4,4,4-trifluoro-N-pyridin-4-ylbutanamide
CID 155981646
N-[4-(difluoromethyl)phenyl]-2,2,2-trifluoroacetamide
CID 130770723

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-pyridin-4-ylacetamide?
The IUPAC name of 2,2,2-trifluoro-N-pyridin-4-ylacetamide (CID 4095205) is 2,2,2-trifluoro-N-pyridin-4-ylacetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-pyridin-4-ylacetamide?
The canonical SMILES for 2,2,2-trifluoro-N-pyridin-4-ylacetamide is O=C(Nc1ccncc1)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-pyridin-4-ylacetamide?
The InChIKey is WQSUOLIZDLLWDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F3N2O/c8-7(9,10)6(13)12-5-1-3-11-4-2-5/h1-4H,(H,11,12,13).
What are the key properties of 2,2,2-trifluoro-N-pyridin-4-ylacetamide?
2,2,2-trifluoro-N-pyridin-4-ylacetamide has a molecular weight of 190.12 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-pyridin-4-ylacetamide is sourced from PubChem (CID 4095205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).