5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole

C10H12F2N4 — CID 132608963

IUPAC5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole
SMILESCc1nn(C)c(F)c1-c1c(C)nn(C)c1F
InChIInChI=1S/C10H12F2N4/c1-5-7(9(11)15(3)13-5)8-6(2)14-16(4)10(8)12/h1-4H3
InChIKeyXKYNNYOVUMKJEQ-UHFFFAOYSA-N
MW226.23 g/mol
LogP1.72
Rot. Bonds1

About 5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole

5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole (PubChem CID 132608963) has the molecular formula C10H12F2N4 and a molecular weight of 226.23 g/mol. Its IUPAC name is 5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole.

Molecular Properties

Compound Name5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole
PubChem CID132608963
Molecular FormulaC10H12F2N4
Molecular Weight226.23 g/mol
Exact Mass226.10
IUPAC Name5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole
SMILESCc1nn(C)c(F)c1-c1c(C)nn(C)c1F
InChIInChI=1S/C10H12F2N4/c1-5-7(9(11)15(3)13-5)8-6(2)14-16(4)10(8)12/h1-4H3
InChIKeyXKYNNYOVUMKJEQ-UHFFFAOYSA-N
XLogP1.72
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.23
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole 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 5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole?
The IUPAC name of 5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole (CID 132608963) is 5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole.
What is the SMILES notation for 5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole?
The canonical SMILES for 5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole is Cc1nn(C)c(F)c1-c1c(C)nn(C)c1F.
What is the InChIKey of 5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole?
The InChIKey is XKYNNYOVUMKJEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2N4/c1-5-7(9(11)15(3)13-5)8-6(2)14-16(4)10(8)12/h1-4H3.
What are the key properties of 5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole?
5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole has a molecular weight of 226.23 g/mol, XLogP of 1.72, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-(5-fluoro-1,3-dimethylpyrazol-4-yl)-1,3-dimethylpyrazole is sourced from PubChem (CID 132608963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).