About methyl(piperidin-1-ylmethyl)diazene
methyl(piperidin-1-ylmethyl)diazene (PubChem CID 143818478) has the molecular formula C7H15N3
and a molecular weight of 141.22 g/mol. Its IUPAC name is methyl(piperidin-1-ylmethyl)diazene.
Molecular Properties
| Compound Name | methyl(piperidin-1-ylmethyl)diazene |
| PubChem CID | 143818478 |
| Molecular Formula | C7H15N3 |
| Molecular Weight | 141.22 g/mol |
| Exact Mass | 141.13 |
| IUPAC Name | methyl(piperidin-1-ylmethyl)diazene |
| SMILES | C/N=N/CN1CCCCC1 |
| InChI | InChI=1S/C7H15N3/c1-8-9-7-10-5-3-2-4-6-10/h2-7H2,1H3/b9-8+ |
| InChIKey | XCENWEBECGSAKA-CMDGGOBGSA-N |
| XLogP | 1.51 |
| TPSA | 27.96 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 141.22 |
| LogP ≤ 5 | 1.51 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'} |
|---|
Analyze methyl(piperidin-1-ylmethyl)diazene 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 methyl(piperidin-1-ylmethyl)diazene?
The IUPAC name of methyl(piperidin-1-ylmethyl)diazene (CID 143818478) is methyl(piperidin-1-ylmethyl)diazene.
What is the SMILES notation for methyl(piperidin-1-ylmethyl)diazene?
The canonical SMILES for methyl(piperidin-1-ylmethyl)diazene is C/N=N/CN1CCCCC1.
What is the InChIKey of methyl(piperidin-1-ylmethyl)diazene?
The InChIKey is XCENWEBECGSAKA-CMDGGOBGSA-N. The full InChI is InChI=1S/C7H15N3/c1-8-9-7-10-5-3-2-4-6-10/h2-7H2,1H3/b9-8+.
What are the key properties of methyl(piperidin-1-ylmethyl)diazene?
methyl(piperidin-1-ylmethyl)diazene has a molecular weight of 141.22 g/mol, XLogP of 1.51, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(piperidin-1-ylmethyl)diazene is sourced from PubChem (CID 143818478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).