2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole

C10H10N4 — CID 96626310

IUPAC2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole
SMILESc1ccc(-n2cc3c(n2)CNC3)nc1
InChIInChI=1S/C10H10N4/c1-2-4-12-10(3-1)14-7-8-5-11-6-9(8)13-14/h1-4,7,11H,5-6H2
InChIKeyCTTWRVWXPVWECP-UHFFFAOYSA-N
MW186.22 g/mol
LogP0.87
Rot. Bonds1

About 2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole

2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole (PubChem CID 96626310) has the molecular formula C10H10N4 and a molecular weight of 186.22 g/mol. Its IUPAC name is 2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole.

Molecular Properties

Compound Name2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole
PubChem CID96626310
Molecular FormulaC10H10N4
Molecular Weight186.22 g/mol
Exact Mass186.09
IUPAC Name2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole
SMILESc1ccc(-n2cc3c(n2)CNC3)nc1
InChIInChI=1S/C10H10N4/c1-2-4-12-10(3-1)14-7-8-5-11-6-9(8)13-14/h1-4,7,11H,5-6H2
InChIKeyCTTWRVWXPVWECP-UHFFFAOYSA-N
XLogP0.87
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.22
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole?
The IUPAC name of 2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole (CID 96626310) is 2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole.
What is the SMILES notation for 2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole?
The canonical SMILES for 2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole is c1ccc(-n2cc3c(n2)CNC3)nc1.
What is the InChIKey of 2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole?
The InChIKey is CTTWRVWXPVWECP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4/c1-2-4-12-10(3-1)14-7-8-5-11-6-9(8)13-14/h1-4,7,11H,5-6H2.
What are the key properties of 2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole?
2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole has a molecular weight of 186.22 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[3,4-c]pyrazole is sourced from PubChem (CID 96626310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).