About 3-[cyclobutylmethyl(ethyl)amino]propanehydrazide
3-[cyclobutylmethyl(ethyl)amino]propanehydrazide (PubChem CID 107402379) has the molecular formula C10H21N3O
and a molecular weight of 199.30 g/mol. Its IUPAC name is 3-[cyclobutylmethyl(ethyl)amino]propanehydrazide.
Molecular Properties
| Compound Name | 3-[cyclobutylmethyl(ethyl)amino]propanehydrazide |
| PubChem CID | 107402379 |
| Molecular Formula | C10H21N3O |
| Molecular Weight | 199.30 g/mol |
| Exact Mass | 199.17 |
| IUPAC Name | 3-[cyclobutylmethyl(ethyl)amino]propanehydrazide |
| SMILES | CCN(CCC(=O)NN)CC1CCC1 |
| InChI | InChI=1S/C10H21N3O/c1-2-13(7-6-10(14)12-11)8-9-4-3-5-9/h9H,2-8,11H2,1H3,(H,12,14) |
| InChIKey | DNZXGPDQHKTIEA-UHFFFAOYSA-N |
| XLogP | 0.49 |
| TPSA | 58.36 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.30 |
| LogP ≤ 5 | 0.49 |
| H-Bond Donors ≤ 5 | 2 |
| 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 3-[cyclobutylmethyl(ethyl)amino]propanehydrazide?
The IUPAC name of 3-[cyclobutylmethyl(ethyl)amino]propanehydrazide (CID 107402379) is 3-[cyclobutylmethyl(ethyl)amino]propanehydrazide.
What is the SMILES notation for 3-[cyclobutylmethyl(ethyl)amino]propanehydrazide?
The canonical SMILES for 3-[cyclobutylmethyl(ethyl)amino]propanehydrazide is CCN(CCC(=O)NN)CC1CCC1.
What is the InChIKey of 3-[cyclobutylmethyl(ethyl)amino]propanehydrazide?
The InChIKey is DNZXGPDQHKTIEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-2-13(7-6-10(14)12-11)8-9-4-3-5-9/h9H,2-8,11H2,1H3,(H,12,14).
What are the key properties of 3-[cyclobutylmethyl(ethyl)amino]propanehydrazide?
3-[cyclobutylmethyl(ethyl)amino]propanehydrazide has a molecular weight of 199.30 g/mol, XLogP of 0.49, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclobutylmethyl(ethyl)amino]propanehydrazide is sourced from PubChem (CID 107402379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).