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amorolfine

Structure via PubChem · Public domain (PubChem)

EntityQ123195· pop 17· linked from 97 articles

amorolfine

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Also known as meso-2,6-dimethyl-4-{2-methyl-3-[4-(2-methylbutan-2-yl)phenyl]propyl}morpholine, meso-2,6-dimethyl-4-(2-methyl-3-(p-tert-pentylphenyl)propyl)morpholine, (+-)-cis-2,6-dimethyl-4-(2-methyl-3-(p-tert-pentylphenyl)propyl)morpholine

Amorolfine (or amorolfin), is a morpholine antifungal drug that inhibits Δ14-sterol reductase and cholestenol Δ-isomerase, which depletes ergosterol and causes ignosterol to accumulate in the fungal cytoplasmic cell membranes. Sold under the brand name Loceryl among others, amorolfine is commonly available in the form of a nail lacquer, containing 5% amorolfine hydrochloride as the active ingredient. It is used to treat onychomycosis (fungal infection of the toe- and fingernails). Amorolfine 5% nail lacquer in once-weekly or twice-weekly applications was shown in two decades-old studies to be

Key facts

Drug.image
Amorolfine.svg
Drug.image_class
skin-invert-image
Drug.caption
Above: molecular structure of amorolfine Below: 3D representation of an amorolfine molecule
Drug.image2
Amorolfine 3D.png
Drug.image_class2
bg-transparent
Drug.tradename
Loceryl, others
Drug.ATC_prefix
D01
Drug.ATC_suffix
AE16
Drug.legal_AU
S4
Drug.legal_AU_comment
/Schedule 2
Drug.CAS_number
78613-35-1
Drug.PubChem
54260
Drug.ChemSpiderID
49010
Drug.UNII
AB0BHP2FH0
Drug.KEGG
D02923
Drug.ChEBI
599440
Drug.ChEMBL
489411
Drug.IUPAC_name
(±)-(2R,6S)-rel-2,6-Dimethyl-4-{2-methyl-3-[4-(2-methylbutan-2-yl)phenyl]propyl}morpholine

via Wikipedia infobox

Chemical data

Formula
C21H35NO
Molecular weight
317.5 g/mol
IUPAC name
(2S,6R)-2,6-dimethyl-4-[2-methyl-3-[4-(2-methylbutan-2-yl)phenyl]propyl]morpholine
SMILES
CCC(C)(C)C1=CC=C(C=C1)CC(C)CN2C[C@H](O[C@H](C2)C)C
InChIKey
MQHLMHIZUIDKOO-AYHJJNSGSA-N
XLogP
5.7
Polar surface area
12.5 Ų
H-bond donors
0
H-bond acceptors
2
Formal charge
0

via PubChem

Drug data · ChEMBL

Max clinical phase
Approved
Molecule type
Small molecule
Indications
tinea unguium

via ChEMBL · EBI

Research

364 papers

via PubMed

Wikidata facts

Mass
317.272
Show 7 more facts
chemical formula
C₂₁H₃₅NO
subject has role
antifungal
Commons category
Amorolfine
canonical SMILES
CCC(C)(C)C1=CC=C(C=C1)CC(C)CN2CC(OC(C2)C)C
isomeric SMILES
CCC(C)(C)C1=CC=C(C=C1)CC(C)CN2C[C@H](O[C@H](C2)C)C
World Health Organisation international non-proprietary name
amorolfine
medical condition treated
dermatomycosis
Sources (4)

via Wikidata · CC0

~3 min read

Encyclopedic overview

1 sections
Contents
  • Notes

{{Infobox drug | image = Amorolfine.svg | image_class = skin-invert-image | alt = | caption = Above: molecular structure of amorolfine Below: 3D representation of an amorolfine molecule | image2 = Amorolfine 3D.png | image_class2 = bg-transparent | alt2 =

| pronounce = | tradename = Loceryl, others | Drugs.com = | MedlinePlus = | DailyMedID = | pregnancy_AU = | pregnancy_AU_comment = | routes_of_administration = | class = | ATC_prefix = D01 | ATC_suffix = AE16 | ATC_supplemental =

Excerpted from Wikipedia’s “amorolfine” article, available under the CC BY-SA 4.0 licence.