3-pyridin-2-yl-2-(trifluoromethyl)pyridine

C11H7F3N2 — CID 68525561

IUPAC3-pyridin-2-yl-2-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ncccc1-c1ccccn1
InChIInChI=1S/C11H7F3N2/c12-11(13,14)10-8(4-3-7-16-10)9-5-1-2-6-15-9/h1-7H
InChIKeyKKFMJRWSFIZKSY-UHFFFAOYSA-N
MW224.19 g/mol
LogP3.16
Rot. Bonds1

About 3-pyridin-2-yl-2-(trifluoromethyl)pyridine

3-pyridin-2-yl-2-(trifluoromethyl)pyridine (PubChem CID 68525561) has the molecular formula C11H7F3N2 and a molecular weight of 224.19 g/mol. Its IUPAC name is 3-pyridin-2-yl-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name3-pyridin-2-yl-2-(trifluoromethyl)pyridine
PubChem CID68525561
Molecular FormulaC11H7F3N2
Molecular Weight224.19 g/mol
Exact Mass224.06
IUPAC Name3-pyridin-2-yl-2-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ncccc1-c1ccccn1
InChIInChI=1S/C11H7F3N2/c12-11(13,14)10-8(4-3-7-16-10)9-5-1-2-6-15-9/h1-7H
InChIKeyKKFMJRWSFIZKSY-UHFFFAOYSA-N
XLogP3.16
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.19
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-pyridin-2-yl-2-(trifluoromethyl)pyridine?
The IUPAC name of 3-pyridin-2-yl-2-(trifluoromethyl)pyridine (CID 68525561) is 3-pyridin-2-yl-2-(trifluoromethyl)pyridine.
What is the SMILES notation for 3-pyridin-2-yl-2-(trifluoromethyl)pyridine?
The canonical SMILES for 3-pyridin-2-yl-2-(trifluoromethyl)pyridine is FC(F)(F)c1ncccc1-c1ccccn1.
What is the InChIKey of 3-pyridin-2-yl-2-(trifluoromethyl)pyridine?
The InChIKey is KKFMJRWSFIZKSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7F3N2/c12-11(13,14)10-8(4-3-7-16-10)9-5-1-2-6-15-9/h1-7H.
What are the key properties of 3-pyridin-2-yl-2-(trifluoromethyl)pyridine?
3-pyridin-2-yl-2-(trifluoromethyl)pyridine has a molecular weight of 224.19 g/mol, XLogP of 3.16, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-2-yl-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 68525561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).