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Butyryl fentanyl-d5 (hydrochloride)

HCID 137699863
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Basic information

Standard SMILES
Cl.[2H]c1c([2H])c([2H])c(N(C(=O)CCC)C2CCN(CCc3ccccc3)CC2)c([2H])c1[2H]
InChIKey
OHCXSXCINRZXIB-JFVIMWSYSA-N
Molecular formula
C23H31ClN2O
Average molar mass
392 g/mol
Monoisotopic mass
391.243875

Names & identifiers

Preferred name
Butyryl fentanyl-d5 (hydrochloride)
IUPAC
N-(2,3,4,5,6-pentadeuteriophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]butanamide;hydrochloride

Names & synonyms

Butyryl fentanyl-d5 (hydrochloride)2747915-19-9DTXSID201038262Butyryl fentanyl phenyl-d5A hydrochlorideN-phenyl-d5-N-[1-(2-phenylethyl)-4-piperidinyl]-butanamide,monohydrochlorideN-(2,3,4,5,6-pentadeuteriophenyl)-N-[1-(2-phenylethyl)-4-piperidyl]butanamide;hydrochloride

Database identifiers

PubChem CID
137699863
DTXSID
DTXSID201038262

Properties

Computed structural properties

Topological polar surface area
23.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
7
Heavy atoms
27
Formal charge
0
Complexity
404

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