3-chloro-5-fluoropyridine;hydrochloride

C5H4Cl2FN — CID 133097839

IUPAC3-chloro-5-fluoropyridine;hydrochloride
SMILESCl.Fc1cncc(Cl)c1
InChIInChI=1S/C5H3ClFN.ClH/c6-4-1-5(7)3-8-2-4;/h1-3H;1H
InChIKeyBQUWKSHPXZSDJV-UHFFFAOYSA-N
MW168.00 g/mol
LogP2.30
Rot. Bonds

About 3-chloro-5-fluoropyridine;hydrochloride

3-chloro-5-fluoropyridine;hydrochloride (PubChem CID 133097839) has the molecular formula C5H4Cl2FN and a molecular weight of 168.00 g/mol. Its IUPAC name is 3-chloro-5-fluoropyridine;hydrochloride.

Molecular Properties

Compound Name3-chloro-5-fluoropyridine;hydrochloride
PubChem CID133097839
Molecular FormulaC5H4Cl2FN
Molecular Weight168.00 g/mol
Exact Mass166.97
IUPAC Name3-chloro-5-fluoropyridine;hydrochloride
SMILESCl.Fc1cncc(Cl)c1
InChIInChI=1S/C5H3ClFN.ClH/c6-4-1-5(7)3-8-2-4;/h1-3H;1H
InChIKeyBQUWKSHPXZSDJV-UHFFFAOYSA-N
XLogP2.30
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.00
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-fluoropyridine;hydrochloride?
The IUPAC name of 3-chloro-5-fluoropyridine;hydrochloride (CID 133097839) is 3-chloro-5-fluoropyridine;hydrochloride.
What is the SMILES notation for 3-chloro-5-fluoropyridine;hydrochloride?
The canonical SMILES for 3-chloro-5-fluoropyridine;hydrochloride is Cl.Fc1cncc(Cl)c1.
What is the InChIKey of 3-chloro-5-fluoropyridine;hydrochloride?
The InChIKey is BQUWKSHPXZSDJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3ClFN.ClH/c6-4-1-5(7)3-8-2-4;/h1-3H;1H.
What are the key properties of 3-chloro-5-fluoropyridine;hydrochloride?
3-chloro-5-fluoropyridine;hydrochloride has a molecular weight of 168.00 g/mol, XLogP of 2.30, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-fluoropyridine;hydrochloride is sourced from PubChem (CID 133097839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).