4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine

C6H2Cl2FN3 — CID 163302223

IUPAC4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine
SMILESFc1cnn2cc(Cl)nc(Cl)c12
InChIInChI=1S/C6H2Cl2FN3/c7-4-2-12-5(6(8)11-4)3(9)1-10-12/h1-2H
InChIKeyMUDIIMIRLKEHAO-UHFFFAOYSA-N
MW206.01 g/mol
LogP2.18
Rot. Bonds

About 4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine

4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine (PubChem CID 163302223) has the molecular formula C6H2Cl2FN3 and a molecular weight of 206.01 g/mol. Its IUPAC name is 4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine
PubChem CID163302223
Molecular FormulaC6H2Cl2FN3
Molecular Weight206.01 g/mol
Exact Mass204.96
IUPAC Name4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine
SMILESFc1cnn2cc(Cl)nc(Cl)c12
InChIInChI=1S/C6H2Cl2FN3/c7-4-2-12-5(6(8)11-4)3(9)1-10-12/h1-2H
InChIKeyMUDIIMIRLKEHAO-UHFFFAOYSA-N
XLogP2.18
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.01
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine?
The IUPAC name of 4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine (CID 163302223) is 4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine?
The canonical SMILES for 4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine is Fc1cnn2cc(Cl)nc(Cl)c12.
What is the InChIKey of 4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine?
The InChIKey is MUDIIMIRLKEHAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2Cl2FN3/c7-4-2-12-5(6(8)11-4)3(9)1-10-12/h1-2H.
What are the key properties of 4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine?
4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine has a molecular weight of 206.01 g/mol, XLogP of 2.18, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-3-fluoropyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 163302223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).