3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole

C5H6N4 — CID 6400924

IUPAC3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole
SMILESCc1[nH]nc2cn[nH]c12
InChIInChI=1S/C5H6N4/c1-3-5-4(8-7-3)2-6-9-5/h2H,1H3,(H,6,9)(H,7,8)
InChIKeyKRAKREBEXWCQMF-UHFFFAOYSA-N
MW122.13 g/mol
LogP0.59
Rot. Bonds

About 3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole

3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole (PubChem CID 6400924) has the molecular formula C5H6N4 and a molecular weight of 122.13 g/mol. Its IUPAC name is 3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole.

Molecular Properties

Compound Name3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole
PubChem CID6400924
Molecular FormulaC5H6N4
Molecular Weight122.13 g/mol
Exact Mass122.06
IUPAC Name3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole
SMILESCc1[nH]nc2cn[nH]c12
InChIInChI=1S/C5H6N4/c1-3-5-4(8-7-3)2-6-9-5/h2H,1H3,(H,6,9)(H,7,8)
InChIKeyKRAKREBEXWCQMF-UHFFFAOYSA-N
XLogP0.59
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.13
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole?
The IUPAC name of 3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole (CID 6400924) is 3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole.
What is the SMILES notation for 3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole?
The canonical SMILES for 3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole is Cc1[nH]nc2cn[nH]c12.
What is the InChIKey of 3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole?
The InChIKey is KRAKREBEXWCQMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N4/c1-3-5-4(8-7-3)2-6-9-5/h2H,1H3,(H,6,9)(H,7,8).
What are the key properties of 3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole?
3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole has a molecular weight of 122.13 g/mol, XLogP of 0.59, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2,4-dihydropyrazolo[4,3-c]pyrazole is sourced from PubChem (CID 6400924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).