1-Piperidinepropanol, alpha,alpha-diphenyl-beta-((isopentyloxy)methyl)-, hydrochloride
Basic information
- CAS
27674-51-7- Standard SMILES
CC(C)CCOCC(CN1CCCCC1)C(O)(c1ccccc1)c1ccccc1.Cl- InChIKey
WEGSRYTZUUJVLR-UHFFFAOYSA-N- Molecular formula
- C26H38ClNO2
- Average molar mass
- 432 g/mol
- Monoisotopic mass
- 431.2591071
Names & identifiers
- Preferred name
- 1-Piperidinepropanol, alpha,alpha-diphenyl-beta-((isopentyloxy)methyl)-, hydrochloride
- IUPAC
- 2-(3-methylbutoxymethyl)-1,1-diphenyl-3-piperidin-1-ylpropan-1-ol;hydrochloride
Names & synonyms
27674-51-71-Piperidinepropanol, alpha,alpha-diphenyl-beta-((isopentyloxy)methyl)-, hydrochloride1-Piperidinepropanol, alpha,alpha-diphenyl-beta-((3-methylbutoxy)methyl)-, hydrochloridealpha,alpha-Diphenyl-beta-((isopentyloxy)methyl)-1-piperidinepropanol hydrochlorideRefChem:234430DTXSID909503232-[(3-Methylbutoxy)methyl]-1,1-diphenyl-3-(piperidin-1-yl)propan-1-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
27674-51-7- PubChem CID
- 214070
- DTXSID
DTXSID90950323
Properties
Computed structural properties
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 416
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Compound notes
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