Basic information
- CAS
119413-53-5- Standard SMILES
Cl.O=C(c1ccco1)N(c1cnccn1)C1CCN(CCc2ccccc2)CC1- InChIKey
KVCOVXMNIYUKBS-UHFFFAOYSA-N- Molecular formula
- C22H25ClN4O2
- Average molar mass
- 412.9 g/mol
- Monoisotopic mass
- 412.1666037
Overview
See also: Mirfentanil (has active moiety).
Names & identifiers
- Preferred name
- Mirfentanil Hydrochloride
- IUPAC
- N-[1-(2-phenylethyl)piperidin-4-yl]-N-pyrazin-2-ylfuran-2-carboxamide;hydrochloride
Names & synonyms
Mirfentanil hydrochlorideMirfentanil HClA-3508 hydrochlorideMirfentanil hydrochloride [USAN]119413-53-5A-3508.HCLUNII-4XFQ391SJU4XFQ391SJUN-(1-Phenylethyl-4-piperidyl)-N-pyrazinyl-2-furamide monohydrochlorideN-(1-Phenethyl-4-piperidinyl)-N-(2-pyrazinyl)furan-2-carboxamide hydrochlorideMirfentanil hydrochloride (USAN)DTXSID20152454
Show more names
2-Furancarboxamide, N-(1-(2-phenylethyl)-4-piperidinyl)-N-pyrazinyl-, monohydrochlorideN-(1-(2-Phenylethyl)-4-piperidinyl)-N-pyrazinyl-2-furancarboxamide monohydrochlorideRefChem:159037DTXCID3074945ANQ-3508 HClSCHEMBL122435CHEMBL2448139SCHEMBL31159615
Database identifiers
- CAS
119413-53-5- PubChem CID
- 60697
- DTXSID
DTXSID20152454- ChEMBL
CHEMBL2448139- UNII
- 4XFQ391SJU
Properties
Computed structural properties
- Topological polar surface area
- 62.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 489
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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