2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide

C7HF7N2O — CID 169302963

IUPAC2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide
SMILESO=C(Nc1c(F)c(F)nc(F)c1F)C(F)(F)F
InChIInChI=1S/C7HF7N2O/c8-1-3(15-6(17)7(12,13)14)2(9)5(11)16-4(1)10/h(H,15,16,17)
InChIKeyIWGQPBDIQWWHHY-UHFFFAOYSA-N
MW262.08 g/mol
LogP2.14
Rot. Bonds1

About 2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide

2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide (PubChem CID 169302963) has the molecular formula C7HF7N2O and a molecular weight of 262.08 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide
PubChem CID169302963
Molecular FormulaC7HF7N2O
Molecular Weight262.08 g/mol
Exact Mass262.00
IUPAC Name2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide
SMILESO=C(Nc1c(F)c(F)nc(F)c1F)C(F)(F)F
InChIInChI=1S/C7HF7N2O/c8-1-3(15-6(17)7(12,13)14)2(9)5(11)16-4(1)10/h(H,15,16,17)
InChIKeyIWGQPBDIQWWHHY-UHFFFAOYSA-N
XLogP2.14
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.08
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide?
The IUPAC name of 2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide (CID 169302963) is 2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide is O=C(Nc1c(F)c(F)nc(F)c1F)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide?
The InChIKey is IWGQPBDIQWWHHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7HF7N2O/c8-1-3(15-6(17)7(12,13)14)2(9)5(11)16-4(1)10/h(H,15,16,17).
What are the key properties of 2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide?
2,2,2-trifluoro-N-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide has a molecular weight of 262.08 g/mol, XLogP of 2.14, 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-(2,3,5,6-tetrafluoro-4-pyridinyl)acetamide is sourced from PubChem (CID 169302963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).