2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole

C8H8N2 — CID 20668093

IUPAC2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole
SMILESC=c1c(C)nn2cccc12
InChIInChI=1S/C8H8N2/c1-6-7(2)9-10-5-3-4-8(6)10/h3-5H,1H2,2H3
InChIKeyAXOXSYBASHGKMP-UHFFFAOYSA-N
MW132.17 g/mol
LogP0.77
Rot. Bonds

About 2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole

2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole (PubChem CID 20668093) has the molecular formula C8H8N2 and a molecular weight of 132.17 g/mol. Its IUPAC name is 2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole.

Molecular Properties

Compound Name2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole
PubChem CID20668093
Molecular FormulaC8H8N2
Molecular Weight132.17 g/mol
Exact Mass132.07
IUPAC Name2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole
SMILESC=c1c(C)nn2cccc12
InChIInChI=1S/C8H8N2/c1-6-7(2)9-10-5-3-4-8(6)10/h3-5H,1H2,2H3
InChIKeyAXOXSYBASHGKMP-UHFFFAOYSA-N
XLogP0.77
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.17
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole?
The IUPAC name of 2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole (CID 20668093) is 2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole.
What is the SMILES notation for 2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole?
The canonical SMILES for 2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole is C=c1c(C)nn2cccc12.
What is the InChIKey of 2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole?
The InChIKey is AXOXSYBASHGKMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2/c1-6-7(2)9-10-5-3-4-8(6)10/h3-5H,1H2,2H3.
What are the key properties of 2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole?
2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole has a molecular weight of 132.17 g/mol, XLogP of 0.77, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-methylidenepyrrolo[1,2-b]pyrazole is sourced from PubChem (CID 20668093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).