3-(3-chloropyrazol-1-yl)-5-fluoropyridine

C8H5ClFN3 — CID 67499436

IUPAC3-(3-chloropyrazol-1-yl)-5-fluoropyridine
SMILESFc1cncc(-n2ccc(Cl)n2)c1
InChIInChI=1S/C8H5ClFN3/c9-8-1-2-13(12-8)7-3-6(10)4-11-5-7/h1-5H
InChIKeyRYUFZMHGMJVLCF-UHFFFAOYSA-N
MW197.60 g/mol
LogP2.06
Rot. Bonds1

About 3-(3-chloropyrazol-1-yl)-5-fluoropyridine

3-(3-chloropyrazol-1-yl)-5-fluoropyridine (PubChem CID 67499436) has the molecular formula C8H5ClFN3 and a molecular weight of 197.60 g/mol. Its IUPAC name is 3-(3-chloropyrazol-1-yl)-5-fluoropyridine.

Molecular Properties

Compound Name3-(3-chloropyrazol-1-yl)-5-fluoropyridine
PubChem CID67499436
Molecular FormulaC8H5ClFN3
Molecular Weight197.60 g/mol
Exact Mass197.02
IUPAC Name3-(3-chloropyrazol-1-yl)-5-fluoropyridine
SMILESFc1cncc(-n2ccc(Cl)n2)c1
InChIInChI=1S/C8H5ClFN3/c9-8-1-2-13(12-8)7-3-6(10)4-11-5-7/h1-5H
InChIKeyRYUFZMHGMJVLCF-UHFFFAOYSA-N
XLogP2.06
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.60
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(3-chloropyrazol-1-yl)-5-fluoropyridine?
The IUPAC name of 3-(3-chloropyrazol-1-yl)-5-fluoropyridine (CID 67499436) is 3-(3-chloropyrazol-1-yl)-5-fluoropyridine.
What is the SMILES notation for 3-(3-chloropyrazol-1-yl)-5-fluoropyridine?
The canonical SMILES for 3-(3-chloropyrazol-1-yl)-5-fluoropyridine is Fc1cncc(-n2ccc(Cl)n2)c1.
What is the InChIKey of 3-(3-chloropyrazol-1-yl)-5-fluoropyridine?
The InChIKey is RYUFZMHGMJVLCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5ClFN3/c9-8-1-2-13(12-8)7-3-6(10)4-11-5-7/h1-5H.
What are the key properties of 3-(3-chloropyrazol-1-yl)-5-fluoropyridine?
3-(3-chloropyrazol-1-yl)-5-fluoropyridine has a molecular weight of 197.60 g/mol, XLogP of 2.06, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chloropyrazol-1-yl)-5-fluoropyridine is sourced from PubChem (CID 67499436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).