2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine

C6H2Cl2FN3 — CID 163301766

IUPAC2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine
SMILESFc1c(Cl)nn2ccnc(Cl)c12
InChIInChI=1S/C6H2Cl2FN3/c7-5-3(9)4-6(8)10-1-2-12(4)11-5/h1-2H
InChIKeyKTUGQPQZDLGYGS-UHFFFAOYSA-N
MW206.01 g/mol
LogP2.18
Rot. Bonds

About 2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine

2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine (PubChem CID 163301766) has the molecular formula C6H2Cl2FN3 and a molecular weight of 206.01 g/mol. Its IUPAC name is 2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine
PubChem CID163301766
Molecular FormulaC6H2Cl2FN3
Molecular Weight206.01 g/mol
Exact Mass204.96
IUPAC Name2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine
SMILESFc1c(Cl)nn2ccnc(Cl)c12
InChIInChI=1S/C6H2Cl2FN3/c7-5-3(9)4-6(8)10-1-2-12(4)11-5/h1-2H
InChIKeyKTUGQPQZDLGYGS-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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Related Compounds

4-Chloropyrazolo[1,5-a]pyrazine
CID 72213177
4-Chloro-6-methylpyrazolo[1,5-a]pyrazine
CID 137965858
4-Chloro-3-iodopyrazolo(1,5-a)pyrazine
CID 145913471
2-Bromo-4-chloropyrazolo(1,5-a)pyrazine
CID 164512828
2-Bromo-4-chloro-3-iodopyrazolo[1,5-a]pyrazine
CID 165980977
3-Bromo-4-chloropyrazolo[1,5-a]pyrazine
CID 132398777
4-Chloro-3-methylpyrazolo(1,5-a)pyrazine
CID 138991397
4-Chloro-3-nitropyrazolo(1,5-a)pyrazine
CID 154809682
3-Bromo-4-chloro-7-iodopyrazolo(1,5-a)pyrazine
CID 155822035
3-Bromo-4-chloro-6-methylpyrazolo[1,5-a]pyrazine
CID 177799120
5,8-Dichloropyrazino[2,3-d]pyridazine
CID 14709714
Pyrazolo[1,5-a]pyrazine
CID 21873758

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine?
The IUPAC name of 2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine (CID 163301766) is 2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine?
The canonical SMILES for 2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine is Fc1c(Cl)nn2ccnc(Cl)c12.
What is the InChIKey of 2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine?
The InChIKey is KTUGQPQZDLGYGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2Cl2FN3/c7-5-3(9)4-6(8)10-1-2-12(4)11-5/h1-2H.
What are the key properties of 2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine?
2,4-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 2,4-dichloro-3-fluoropyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 163301766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).