4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride

C6H11Cl2N3 — CID 70700332

IUPAC4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride
SMILESCl.Cl.c1cc2n(n1)CCNC2
InChIInChI=1S/C6H9N3.2ClH/c1-2-8-9-4-3-7-5-6(1)9;;/h1-2,7H,3-5H2;2*1H
InChIKeyKGMICXXVEAZRJU-UHFFFAOYSA-N
MW196.08 g/mol
LogP0.83
Rot. Bonds

About 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride

4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride (PubChem CID 70700332) has the molecular formula C6H11Cl2N3 and a molecular weight of 196.08 g/mol. Its IUPAC name is 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride.

Molecular Properties

Compound Name4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride
PubChem CID70700332
Molecular FormulaC6H11Cl2N3
Molecular Weight196.08 g/mol
Exact Mass195.03
IUPAC Name4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride
SMILESCl.Cl.c1cc2n(n1)CCNC2
InChIInChI=1S/C6H9N3.2ClH/c1-2-8-9-4-3-7-5-6(1)9;;/h1-2,7H,3-5H2;2*1H
InChIKeyKGMICXXVEAZRJU-UHFFFAOYSA-N
XLogP0.83
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.08
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride?
The IUPAC name of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride (CID 70700332) is 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride.
What is the SMILES notation for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride?
The canonical SMILES for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride is Cl.Cl.c1cc2n(n1)CCNC2.
What is the InChIKey of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride?
The InChIKey is KGMICXXVEAZRJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3.2ClH/c1-2-8-9-4-3-7-5-6(1)9;;/h1-2,7H,3-5H2;2*1H.
What are the key properties of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride?
4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride has a molecular weight of 196.08 g/mol, XLogP of 0.83, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride is sourced from PubChem (CID 70700332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).