2-(difluoromethyl)pyridine

C6H5F2N — CID 639501

IUPAC2-(difluoromethyl)pyridine
SMILESFC(F)c1ccccn1
InChIInChI=1S/C6H5F2N/c7-6(8)5-3-1-2-4-9-5/h1-4,6H
InChIKeyKUHSAAHTEMAJTF-UHFFFAOYSA-N
MW129.11 g/mol
LogP2.02
Rot. Bonds1

About 2-(difluoromethyl)pyridine

2-(difluoromethyl)pyridine (PubChem CID 639501) has the molecular formula C6H5F2N and a molecular weight of 129.11 g/mol. Its IUPAC name is 2-(difluoromethyl)pyridine.

Molecular Properties

Compound Name2-(difluoromethyl)pyridine
PubChem CID639501
Molecular FormulaC6H5F2N
Molecular Weight129.11 g/mol
Exact Mass129.04
IUPAC Name2-(difluoromethyl)pyridine
SMILESFC(F)c1ccccn1
InChIInChI=1S/C6H5F2N/c7-6(8)5-3-1-2-4-9-5/h1-4,6H
InChIKeyKUHSAAHTEMAJTF-UHFFFAOYSA-N
XLogP2.02
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.11
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)pyridine?
The IUPAC name of 2-(difluoromethyl)pyridine (CID 639501) is 2-(difluoromethyl)pyridine.
What is the SMILES notation for 2-(difluoromethyl)pyridine?
The canonical SMILES for 2-(difluoromethyl)pyridine is FC(F)c1ccccn1.
What is the InChIKey of 2-(difluoromethyl)pyridine?
The InChIKey is KUHSAAHTEMAJTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F2N/c7-6(8)5-3-1-2-4-9-5/h1-4,6H.
What are the key properties of 2-(difluoromethyl)pyridine?
2-(difluoromethyl)pyridine has a molecular weight of 129.11 g/mol, XLogP of 2.02, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)pyridine is sourced from PubChem (CID 639501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).