6-chloro-3-fluoropyrazolo[1,5-a]pyrazine

C6H3ClFN3 — CID 171511528

IUPAC6-chloro-3-fluoropyrazolo[1,5-a]pyrazine
SMILESFc1cnn2cc(Cl)ncc12
InChIInChI=1S/C6H3ClFN3/c7-6-3-11-5(2-9-6)4(8)1-10-11/h1-3H
InChIKeyJGXUAFXLPVCUJJ-UHFFFAOYSA-N
MW171.56 g/mol
LogP1.52
Rot. Bonds

About 6-chloro-3-fluoropyrazolo[1,5-a]pyrazine

6-chloro-3-fluoropyrazolo[1,5-a]pyrazine (PubChem CID 171511528) has the molecular formula C6H3ClFN3 and a molecular weight of 171.56 g/mol. Its IUPAC name is 6-chloro-3-fluoropyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name6-chloro-3-fluoropyrazolo[1,5-a]pyrazine
PubChem CID171511528
Molecular FormulaC6H3ClFN3
Molecular Weight171.56 g/mol
Exact Mass171.00
IUPAC Name6-chloro-3-fluoropyrazolo[1,5-a]pyrazine
SMILESFc1cnn2cc(Cl)ncc12
InChIInChI=1S/C6H3ClFN3/c7-6-3-11-5(2-9-6)4(8)1-10-11/h1-3H
InChIKeyJGXUAFXLPVCUJJ-UHFFFAOYSA-N
XLogP1.52
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.56
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-Chloropyrazolo[1,5-a]pyrazine
CID 72213177
3-Bromopyrazolo[1,5-a]pyrazine
CID 67123766
Pyrazolo(1,5-a)pyrazin-3-amine
CID 69460984
4-Chloro-6-methylpyrazolo[1,5-a]pyrazine
CID 137965858
4-Chloro-3-iodopyrazolo(1,5-a)pyrazine
CID 145913471
3-Bromo-4-chloropyrazolo[1,5-a]pyrazine
CID 132398777
4-Chloro-3-methylpyrazolo(1,5-a)pyrazine
CID 138991397
3-Bromo-4-chloro-7-iodopyrazolo(1,5-a)pyrazine
CID 155822035
6,7-Dimethylpyrazolo(1,5-a)pyrazin-3-amine dihydrochloride
CID 165770821
3-Bromo-4-chloro-6-methylpyrazolo[1,5-a]pyrazine
CID 177799120
Pyrazolo[1,5-a]pyrazine
CID 21873758
2,4-Dichloro-3-fluoropyrazolo[1,5-a]pyrazine
CID 163301766

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-fluoropyrazolo[1,5-a]pyrazine?
The IUPAC name of 6-chloro-3-fluoropyrazolo[1,5-a]pyrazine (CID 171511528) is 6-chloro-3-fluoropyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 6-chloro-3-fluoropyrazolo[1,5-a]pyrazine?
The canonical SMILES for 6-chloro-3-fluoropyrazolo[1,5-a]pyrazine is Fc1cnn2cc(Cl)ncc12.
What is the InChIKey of 6-chloro-3-fluoropyrazolo[1,5-a]pyrazine?
The InChIKey is JGXUAFXLPVCUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3ClFN3/c7-6-3-11-5(2-9-6)4(8)1-10-11/h1-3H.
What are the key properties of 6-chloro-3-fluoropyrazolo[1,5-a]pyrazine?
6-chloro-3-fluoropyrazolo[1,5-a]pyrazine has a molecular weight of 171.56 g/mol, XLogP of 1.52, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-fluoropyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 171511528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).