5-bromo-1-(2-fluoroethyl)-2H-pyridine

C7H9BrFN — CID 141279726

IUPAC5-bromo-1-(2-fluoroethyl)-2H-pyridine
SMILESFCCN1C=C(Br)C=CC1
InChIInChI=1S/C7H9BrFN/c8-7-2-1-4-10(6-7)5-3-9/h1-2,6H,3-5H2
InChIKeyRJFQYMNJXOQQHB-UHFFFAOYSA-N
MW206.06 g/mol
LogP2.06
Rot. Bonds2

About 5-bromo-1-(2-fluoroethyl)-2H-pyridine

5-bromo-1-(2-fluoroethyl)-2H-pyridine (PubChem CID 141279726) has the molecular formula C7H9BrFN and a molecular weight of 206.06 g/mol. Its IUPAC name is 5-bromo-1-(2-fluoroethyl)-2H-pyridine.

Molecular Properties

Compound Name5-bromo-1-(2-fluoroethyl)-2H-pyridine
PubChem CID141279726
Molecular FormulaC7H9BrFN
Molecular Weight206.06 g/mol
Exact Mass204.99
IUPAC Name5-bromo-1-(2-fluoroethyl)-2H-pyridine
SMILESFCCN1C=C(Br)C=CC1
InChIInChI=1S/C7H9BrFN/c8-7-2-1-4-10(6-7)5-3-9/h1-2,6H,3-5H2
InChIKeyRJFQYMNJXOQQHB-UHFFFAOYSA-N
XLogP2.06
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.06
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-1-(2-fluoroethyl)-2H-pyridine?
The IUPAC name of 5-bromo-1-(2-fluoroethyl)-2H-pyridine (CID 141279726) is 5-bromo-1-(2-fluoroethyl)-2H-pyridine.
What is the SMILES notation for 5-bromo-1-(2-fluoroethyl)-2H-pyridine?
The canonical SMILES for 5-bromo-1-(2-fluoroethyl)-2H-pyridine is FCCN1C=C(Br)C=CC1.
What is the InChIKey of 5-bromo-1-(2-fluoroethyl)-2H-pyridine?
The InChIKey is RJFQYMNJXOQQHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9BrFN/c8-7-2-1-4-10(6-7)5-3-9/h1-2,6H,3-5H2.
What are the key properties of 5-bromo-1-(2-fluoroethyl)-2H-pyridine?
5-bromo-1-(2-fluoroethyl)-2H-pyridine has a molecular weight of 206.06 g/mol, XLogP of 2.06, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-1-(2-fluoroethyl)-2H-pyridine is sourced from PubChem (CID 141279726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).