3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine

C10H14N4 — CID 146037688

IUPAC3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine
SMILESCc1cnn2cc(C(C)(C)C)nnc12
InChIInChI=1S/C10H14N4/c1-7-5-11-14-6-8(10(2,3)4)12-13-9(7)14/h5-6H,1-4H3
InChIKeyCAONXZIISMGZTB-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.73
Rot. Bonds

About 3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine

3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine (PubChem CID 146037688) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine.

Molecular Properties

Compound Name3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine
PubChem CID146037688
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine
SMILESCc1cnn2cc(C(C)(C)C)nnc12
InChIInChI=1S/C10H14N4/c1-7-5-11-14-6-8(10(2,3)4)12-13-9(7)14/h5-6H,1-4H3
InChIKeyCAONXZIISMGZTB-UHFFFAOYSA-N
XLogP1.73
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine 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 3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine?
The IUPAC name of 3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine (CID 146037688) is 3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine.
What is the SMILES notation for 3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine?
The canonical SMILES for 3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine is Cc1cnn2cc(C(C)(C)C)nnc12.
What is the InChIKey of 3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine?
The InChIKey is CAONXZIISMGZTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-7-5-11-14-6-8(10(2,3)4)12-13-9(7)14/h5-6H,1-4H3.
What are the key properties of 3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine?
3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine has a molecular weight of 190.25 g/mol, XLogP of 1.73, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-8-methylpyrazolo[5,1-c][1,2,4]triazine is sourced from PubChem (CID 146037688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).