4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole

C8H9FN4 — CID 89032514

IUPAC4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole
SMILESCc1c(F)c(-n2cccn2)nn1C
InChIInChI=1S/C8H9FN4/c1-6-7(9)8(11-12(6)2)13-5-3-4-10-13/h3-5H,1-2H3
InChIKeyRNESCUCANFIFIX-UHFFFAOYSA-N
MW180.19 g/mol
LogP1.05
Rot. Bonds1

About 4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole

4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole (PubChem CID 89032514) has the molecular formula C8H9FN4 and a molecular weight of 180.19 g/mol. Its IUPAC name is 4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole.

Molecular Properties

Compound Name4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole
PubChem CID89032514
Molecular FormulaC8H9FN4
Molecular Weight180.19 g/mol
Exact Mass180.08
IUPAC Name4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole
SMILESCc1c(F)c(-n2cccn2)nn1C
InChIInChI=1S/C8H9FN4/c1-6-7(9)8(11-12(6)2)13-5-3-4-10-13/h3-5H,1-2H3
InChIKeyRNESCUCANFIFIX-UHFFFAOYSA-N
XLogP1.05
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.19
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole?
The IUPAC name of 4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole (CID 89032514) is 4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole.
What is the SMILES notation for 4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole?
The canonical SMILES for 4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole is Cc1c(F)c(-n2cccn2)nn1C.
What is the InChIKey of 4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole?
The InChIKey is RNESCUCANFIFIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FN4/c1-6-7(9)8(11-12(6)2)13-5-3-4-10-13/h3-5H,1-2H3.
What are the key properties of 4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole?
4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole has a molecular weight of 180.19 g/mol, XLogP of 1.05, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1,5-dimethyl-3-pyrazol-1-ylpyrazole is sourced from PubChem (CID 89032514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).