About N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide
N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide (PubChem CID 116845050) has the molecular formula C10H21N3O
and a molecular weight of 199.30 g/mol. Its IUPAC name is N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide.
Molecular Properties
| Compound Name | N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide |
| PubChem CID | 116845050 |
| Molecular Formula | C10H21N3O |
| Molecular Weight | 199.30 g/mol |
| Exact Mass | 199.17 |
| IUPAC Name | N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide |
| SMILES | CN1CCCC(CCC(=O)N(C)N)C1 |
| InChI | InChI=1S/C10H21N3O/c1-12-7-3-4-9(8-12)5-6-10(14)13(2)11/h9H,3-8,11H2,1-2H3 |
| InChIKey | ZUZSAKSNGZHTOZ-UHFFFAOYSA-N |
| XLogP | 0.44 |
| TPSA | 49.57 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.30 |
| LogP ≤ 5 | 0.44 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide?
The IUPAC name of N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide (CID 116845050) is N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide.
What is the SMILES notation for N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide?
The canonical SMILES for N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide is CN1CCCC(CCC(=O)N(C)N)C1.
What is the InChIKey of N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide?
The InChIKey is ZUZSAKSNGZHTOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-12-7-3-4-9(8-12)5-6-10(14)13(2)11/h9H,3-8,11H2,1-2H3.
What are the key properties of N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide?
N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide has a molecular weight of 199.30 g/mol, XLogP of 0.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(1-methylpiperidin-3-yl)propanehydrazide is sourced from PubChem (CID 116845050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).