3-Ethyl-5-(N-dimethylaminomethylenaminomethyl)-isoxazole
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Basic information
- Standard SMILES
CCc1cc(CN=CN(C)C)on1- InChIKey
LSJOHBHITZPGPZ-UHFFFAOYSA-N- Molecular formula
- C9H15N3O
- Average molar mass
- 181.23 g/mol
Names & identifiers
- Preferred name
- 3-Ethyl-5-(N-dimethylaminomethylenaminomethyl)-isoxazole
- IUPAC
- N'-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,N-dimethylmethanimidamide
Names & synonyms
SCHEMBL9471580SCHEMBL9471586LSJOHBHITZPGPZ-UHFFFAOYSA-N3-Ethyl-5-(N-dimethylaminomethylenaminomethyl)-isoxazole
Database identifiers
- PubChem CID
- 19786948
Properties
Computed structural propertiesFilling in
- XLogP
- 0.8
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 170
Related reactions
1 records
Compound notes
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