3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole

C6H8N4 — CID 18724708

IUPAC3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole
SMILESCC1=Nn2c(C)nnc2C1
InChIInChI=1S/C6H8N4/c1-4-3-6-8-7-5(2)10(6)9-4/h3H2,1-2H3
InChIKeyRRMDBJSTWHAXFN-UHFFFAOYSA-N
MW136.16 g/mol
LogP0.37
Rot. Bonds

About 3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole

3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole (PubChem CID 18724708) has the molecular formula C6H8N4 and a molecular weight of 136.16 g/mol. Its IUPAC name is 3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole.

Molecular Properties

Compound Name3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole
PubChem CID18724708
Molecular FormulaC6H8N4
Molecular Weight136.16 g/mol
Exact Mass136.07
IUPAC Name3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole
SMILESCC1=Nn2c(C)nnc2C1
InChIInChI=1S/C6H8N4/c1-4-3-6-8-7-5(2)10(6)9-4/h3H2,1-2H3
InChIKeyRRMDBJSTWHAXFN-UHFFFAOYSA-N
XLogP0.37
TPSA43.07 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.16
LogP ≤ 50.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole with MolForge

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

Launch Full Analysis

Related Compounds

3,5-Diethyl-4h-1,2,4-triazol-4-amine
CID 221248
3,5-Dipropyl-1,2,4-triazol-4-ylamine
CID 2758722
6-methyl-3-(trifluoromethyl)-7H-pyrazolo[5,1-c][1,2,4]triazole
CID 22944551
3-Ethyl-5-methyl-1,2,4-triazol-4-amine
CID 10701840
2,6-dimethyl-7H-pyrazolo[1,5-b][1,2,4]triazole
CID 18724706
6-methyl-2-propan-2-yl-7H-pyrazolo[1,5-b][1,2,4]triazole
CID 22944513
6-methoxy-3-methyl-7H-pyrazolo[5,1-c][1,2,4]triazole
CID 22944514
1-ethyl-3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazol-4-ium
CID 22944533
1,2-diethyl-6-methyl-7H-pyrazolo[1,5-b][1,2,4]triazol-1-ium
CID 22944544
2,6-Dimethyl-7-methylidenepyrazolo[1,5-b][1,2,4]triazole
CID 57879743
2-(5-Methyl-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl)ethylidenetungsten;tungsten
CID 58599531
2,5-dimethyl-6H-imidazo[1,2-b][1,2,4]triazole
CID 59119708

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole?
The IUPAC name of 3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole (CID 18724708) is 3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole.
What is the SMILES notation for 3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole?
The canonical SMILES for 3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole is CC1=Nn2c(C)nnc2C1.
What is the InChIKey of 3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole?
The InChIKey is RRMDBJSTWHAXFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4/c1-4-3-6-8-7-5(2)10(6)9-4/h3H2,1-2H3.
What are the key properties of 3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole?
3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole has a molecular weight of 136.16 g/mol, XLogP of 0.37, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-7H-pyrazolo[5,1-c][1,2,4]triazole is sourced from PubChem (CID 18724708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).