4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole

C7H9N4+ — CID 173358573

IUPAC4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole
SMILESCc1cn[nH]c1[NH+]1C=CC=N1
InChIInChI=1S/C7H8N4/c1-6-5-8-10-7(6)11-4-2-3-9-11/h2-5H,1H3,(H,8,10)/p+1
InChIKeyZRMHWRZZSSCADP-UHFFFAOYSA-O
MW149.18 g/mol
LogP-0.25
Rot. Bonds1

About 4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole

4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole (PubChem CID 173358573) has the molecular formula C7H9N4+ and a molecular weight of 149.18 g/mol. Its IUPAC name is 4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole.

Molecular Properties

Compound Name4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole
PubChem CID173358573
Molecular FormulaC7H9N4+
Molecular Weight149.18 g/mol
Exact Mass149.08
IUPAC Name4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole
SMILESCc1cn[nH]c1[NH+]1C=CC=N1
InChIInChI=1S/C7H8N4/c1-6-5-8-10-7(6)11-4-2-3-9-11/h2-5H,1H3,(H,8,10)/p+1
InChIKeyZRMHWRZZSSCADP-UHFFFAOYSA-O
XLogP-0.25
TPSA45.48 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.18
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole 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-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole?
The IUPAC name of 4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole (CID 173358573) is 4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole.
What is the SMILES notation for 4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole?
The canonical SMILES for 4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole is Cc1cn[nH]c1[NH+]1C=CC=N1.
What is the InChIKey of 4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole?
The InChIKey is ZRMHWRZZSSCADP-UHFFFAOYSA-O. The full InChI is InChI=1S/C7H8N4/c1-6-5-8-10-7(6)11-4-2-3-9-11/h2-5H,1H3,(H,8,10)/p+1.
What are the key properties of 4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole?
4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole has a molecular weight of 149.18 g/mol, XLogP of -0.25, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(1H-pyrazol-1-ium-1-yl)-1H-pyrazole is sourced from PubChem (CID 173358573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).