Basic information
- CAS
7041-74-9- Standard SMILES
Cl.OC(CN1CCCCC1)c1cc(-c2ccccc2)no1- InChIKey
JNYQXPNTBMOGFN-UHFFFAOYSA-N- Molecular formula
- C16H21ClN2O2
- Average molar mass
- 308.8 g/mol
- Monoisotopic mass
- 308.1291556
Names & identifiers
- Preferred name
- 1-(3-Phenyl-1,2-oxazol-5-yl)-2-(piperidin-1-yl)ethan-1-ol--hydrogen chloride (1/1)
- IUPAC
- 1-(3-phenyl-1,2-oxazol-5-yl)-2-piperidin-1-ylethanol;hydrochloride
Names & synonyms
7041-74-9DTXSID009906141-(3-Phenyl-1,2-oxazol-5-yl)-2-(piperidin-1-yl)ethan-1-ol--hydrogen chloride (1/1)RefChem:1054219DTXCID5014177123-Phenyl-5-(1-hydroxy-2-piperidinoethyl)isoxazole hydrochloride1-Piperidineethanol, alpha-(3-phenyl-5-isoxazolyl)-, monohydrochlorideIsoxazole, 5-(1-hydroxy-2-piperidinoethyl)-3-phenyl-, hydrochlorideNSC288401NSC-288401
Database identifiers
- CAS
7041-74-9- PubChem CID
- 201878
- DTXSID
DTXSID00990614
Properties
Computed structural properties
- Topological polar surface area
- 49.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 288
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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