1-Pyrrolidineacetamide, N-(3-(2-thienyl)-5-isoxazolyl)-, monohydrochloride
Basic information
- CAS
37852-48-5- Standard SMILES
Cl.O=C(CN1CCCC1)Nc1cc(-c2cccs2)no1- InChIKey
GJOPVJITOCWMMW-UHFFFAOYSA-N- Molecular formula
- C13H16ClN3O2S
- Average molar mass
- 313.8 g/mol
- Monoisotopic mass
- 313.0651756
Names & identifiers
- Preferred name
- 1-Pyrrolidineacetamide, N-(3-(2-thienyl)-5-isoxazolyl)-, monohydrochloride
- IUPAC
- 2-pyrrolidin-1-yl-N-(3-thiophen-2-yl-1,2-oxazol-5-yl)acetamide;hydrochloride
Names & synonyms
1-Pyrrolidineacetamide, N-(3-(2-thienyl)-5-isoxazolyl)-, monohydrochlorideN-(3-(2-Thienyl)-5-isoxazolyl)-1-pyrrolidineacetamide monohydrochloride37852-48-5DTXSID20191287RefChem:235177DTXCID301137782-(Pyrrolidin-1-yl)-N-[3-(thiophen-2-yl)-1,2-oxazol-5-yl]acetamide--hydrogen chloride (1/1)
Database identifiers
- CAS
37852-48-5- PubChem CID
- 216883
- DTXSID
DTXSID20191287
Properties
Computed structural properties
- Topological polar surface area
- 86.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 323
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Compound notes
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