About 2-(1-methoxycyclobutyl)acetohydrazide
2-(1-methoxycyclobutyl)acetohydrazide (PubChem CID 103555801) has the molecular formula C7H14N2O2
and a molecular weight of 158.20 g/mol. Its IUPAC name is 2-(1-methoxycyclobutyl)acetohydrazide.
Molecular Properties
| Compound Name | 2-(1-methoxycyclobutyl)acetohydrazide |
| PubChem CID | 103555801 |
| Molecular Formula | C7H14N2O2 |
| Molecular Weight | 158.20 g/mol |
| Exact Mass | 158.11 |
| IUPAC Name | 2-(1-methoxycyclobutyl)acetohydrazide |
| SMILES | COC1(CC(=O)NN)CCC1 |
| InChI | InChI=1S/C7H14N2O2/c1-11-7(3-2-4-7)5-6(10)9-8/h2-5,8H2,1H3,(H,9,10) |
| InChIKey | YDHOFPGTLUFYLR-UHFFFAOYSA-N |
| XLogP | -0.06 |
| TPSA | 64.35 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 158.20 |
| LogP ≤ 5 | -0.06 |
| 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 2-(1-methoxycyclobutyl)acetohydrazide?
The IUPAC name of 2-(1-methoxycyclobutyl)acetohydrazide (CID 103555801) is 2-(1-methoxycyclobutyl)acetohydrazide.
What is the SMILES notation for 2-(1-methoxycyclobutyl)acetohydrazide?
The canonical SMILES for 2-(1-methoxycyclobutyl)acetohydrazide is COC1(CC(=O)NN)CCC1.
What is the InChIKey of 2-(1-methoxycyclobutyl)acetohydrazide?
The InChIKey is YDHOFPGTLUFYLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-11-7(3-2-4-7)5-6(10)9-8/h2-5,8H2,1H3,(H,9,10).
What are the key properties of 2-(1-methoxycyclobutyl)acetohydrazide?
2-(1-methoxycyclobutyl)acetohydrazide has a molecular weight of 158.20 g/mol, XLogP of -0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclobutyl)acetohydrazide is sourced from PubChem (CID 103555801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).