2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide

C14H11F3N2O — CID 110696997

IUPAC2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1ccccn1)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C14H11F3N2O/c15-14(16,17)11-6-1-2-7-12(11)19-13(20)9-10-5-3-4-8-18-10/h1-8H,9H2,(H,19,20)
InChIKeyMLFRTTSXHIMPQU-UHFFFAOYSA-N
MW280.25 g/mol
LogP3.28
Rot. Bonds3

About 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide

2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide (PubChem CID 110696997) has the molecular formula C14H11F3N2O and a molecular weight of 280.25 g/mol. Its IUPAC name is 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide
PubChem CID110696997
Molecular FormulaC14H11F3N2O
Molecular Weight280.25 g/mol
Exact Mass280.08
IUPAC Name2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1ccccn1)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C14H11F3N2O/c15-14(16,17)11-6-1-2-7-12(11)19-13(20)9-10-5-3-4-8-18-10/h1-8H,9H2,(H,19,20)
InChIKeyMLFRTTSXHIMPQU-UHFFFAOYSA-N
XLogP3.28
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.25
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide (CID 110696997) is 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide is O=C(Cc1ccccn1)Nc1ccccc1C(F)(F)F.
What is the InChIKey of 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide?
The InChIKey is MLFRTTSXHIMPQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3N2O/c15-14(16,17)11-6-1-2-7-12(11)19-13(20)9-10-5-3-4-8-18-10/h1-8H,9H2,(H,19,20).
What are the key properties of 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide?
2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide has a molecular weight of 280.25 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 110696997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).