5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole

C6H8N2 — CID 11073365

IUPAC5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole
SMILESc1cc2n(n1)CCC2
InChIInChI=1S/C6H8N2/c1-2-6-3-4-7-8(6)5-1/h3-4H,1-2,5H2
InChIKeyLQKUERRPRLVSLZ-UHFFFAOYSA-N
MW108.14 g/mol
LogP0.83
Rot. Bonds

About 5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole

5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole (PubChem CID 11073365) has the molecular formula C6H8N2 and a molecular weight of 108.14 g/mol. Its IUPAC name is 5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole.

Molecular Properties

Compound Name5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole
PubChem CID11073365
Molecular FormulaC6H8N2
Molecular Weight108.14 g/mol
Exact Mass108.07
IUPAC Name5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole
SMILESc1cc2n(n1)CCC2
InChIInChI=1S/C6H8N2/c1-2-6-3-4-7-8(6)5-1/h3-4H,1-2,5H2
InChIKeyLQKUERRPRLVSLZ-UHFFFAOYSA-N
XLogP0.83
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.14
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 25247549
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CID 25248374
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Frequently Asked Questions

What is the IUPAC name of 5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole?
The IUPAC name of 5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole (CID 11073365) is 5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole.
What is the SMILES notation for 5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole?
The canonical SMILES for 5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole is c1cc2n(n1)CCC2.
What is the InChIKey of 5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole?
The InChIKey is LQKUERRPRLVSLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2/c1-2-6-3-4-7-8(6)5-1/h3-4H,1-2,5H2.
What are the key properties of 5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole?
5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole has a molecular weight of 108.14 g/mol, XLogP of 0.83, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole is sourced from PubChem (CID 11073365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).