About N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide
N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide (PubChem CID 579267) has the molecular formula C10H17NO2
and a molecular weight of 183.25 g/mol. Its IUPAC name is N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide.
Molecular Properties
| Compound Name | N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide |
| PubChem CID | 579267 |
| Molecular Formula | C10H17NO2 |
| Molecular Weight | 183.25 g/mol |
| Exact Mass | 183.13 |
| IUPAC Name | N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide |
| SMILES | CC(C)=CC1C(C(=O)NO)C1(C)C |
| InChI | InChI=1S/C10H17NO2/c1-6(2)5-7-8(9(12)11-13)10(7,3)4/h5,7-8,13H,1-4H3,(H,11,12) |
| InChIKey | RMKXVFSISJGZHP-UHFFFAOYSA-N |
| XLogP | 1.73 |
| TPSA | 49.33 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 183.25 |
| LogP ≤ 5 | 1.73 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide?
The IUPAC name of N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide (CID 579267) is N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide is CC(C)=CC1C(C(=O)NO)C1(C)C.
What is the InChIKey of N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide?
The InChIKey is RMKXVFSISJGZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-6(2)5-7-8(9(12)11-13)10(7,3)4/h5,7-8,13H,1-4H3,(H,11,12).
What are the key properties of N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide?
N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide has a molecular weight of 183.25 g/mol, XLogP of 1.73, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 579267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).