1-(1H-pyrazol-5-yl)pyrazole

C6H6N4 — CID 5324090

IUPAC1-(1H-pyrazol-5-yl)pyrazole
SMILESc1cnn(-c2ccn[nH]2)c1
InChIInChI=1S/C6H6N4/c1-3-8-10(5-1)6-2-4-7-9-6/h1-5H,(H,7,9)
InChIKeyLVJQRFPFXVQMJC-UHFFFAOYSA-N
MW134.14 g/mol
LogP0.60
Rot. Bonds1

About 1-(1H-pyrazol-5-yl)pyrazole

1-(1H-pyrazol-5-yl)pyrazole (PubChem CID 5324090) has the molecular formula C6H6N4 and a molecular weight of 134.14 g/mol. Its IUPAC name is 1-(1H-pyrazol-5-yl)pyrazole.

Molecular Properties

Compound Name1-(1H-pyrazol-5-yl)pyrazole
PubChem CID5324090
Molecular FormulaC6H6N4
Molecular Weight134.14 g/mol
Exact Mass134.06
IUPAC Name1-(1H-pyrazol-5-yl)pyrazole
SMILESc1cnn(-c2ccn[nH]2)c1
InChIInChI=1S/C6H6N4/c1-3-8-10(5-1)6-2-4-7-9-6/h1-5H,(H,7,9)
InChIKeyLVJQRFPFXVQMJC-UHFFFAOYSA-N
XLogP0.60
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.14
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-pyrazol-5-yl)pyrazole?
The IUPAC name of 1-(1H-pyrazol-5-yl)pyrazole (CID 5324090) is 1-(1H-pyrazol-5-yl)pyrazole.
What is the SMILES notation for 1-(1H-pyrazol-5-yl)pyrazole?
The canonical SMILES for 1-(1H-pyrazol-5-yl)pyrazole is c1cnn(-c2ccn[nH]2)c1.
What is the InChIKey of 1-(1H-pyrazol-5-yl)pyrazole?
The InChIKey is LVJQRFPFXVQMJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4/c1-3-8-10(5-1)6-2-4-7-9-6/h1-5H,(H,7,9).
What are the key properties of 1-(1H-pyrazol-5-yl)pyrazole?
1-(1H-pyrazol-5-yl)pyrazole has a molecular weight of 134.14 g/mol, XLogP of 0.60, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-pyrazol-5-yl)pyrazole is sourced from PubChem (CID 5324090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).