Basic information
- CAS
91141-21-8- Standard SMILES
CCN(CC)CC(=O)Nc1cc(C)no1- InChIKey
HSRKXSSNMPSEKO-UHFFFAOYSA-N- Molecular formula
- C10H17N3O2
- Average molar mass
- 211.26 g/mol
- Monoisotopic mass
- 211.13207679
Names & identifiers
- Preferred name
- Isoxazole, 5-(2-(diethylamino)acetamido)-3-methyl-
- IUPAC
- 2-(diethylamino)-N-(3-methyl-1,2-oxazol-5-yl)acetamide
Names & synonyms
BRN 0983444ISOXAZOLE, 5-(2-(DIETHYLAMINO)ACETAMIDO)-3-METHYL-5-(2-(Diethylamino)acetamido)-3-methylisoxazole91141-21-8DTXSID20238424RefChem:350230DTXCID40160915N~2~,N~2~-Diethyl-N-(3-methyl-1,2-oxazol-5-yl)glycinamide
Database identifiers
- CAS
91141-21-8- PubChem CID
- 56191
- DTXSID
DTXSID20238424- Nikkaji
- J68.873H
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 207
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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