17-(Cyclobutylmethyl)morphinan-3,14-diol

HCID 2487
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Basic information

Standard SMILES
Oc1ccc2c(c1)C13CCCCC1(O)C(C2)N(CC1CCC1)CC3
InChIKey
IFKLAQQSCNILHL-UHFFFAOYSA-N
Molecular formula
C21H29NO2
Average molar mass
327.5 g/mol
Monoisotopic mass
327.21982917

Names & identifiers

Preferred name
17-(Cyclobutylmethyl)morphinan-3,14-diol
IUPAC
17-(cyclobutylmethyl)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-diol

Names & synonyms

DTXSID70860592RefChem:1057602DTXCID2020919917-(Cyclobutylmethyl)morphinan-3,14-diol17-(cyclobutylmethyl)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene-4,10-dioll-BC 2627SCHEMBL10031253IFKLAQQSCNILHL-UHFFFAOYSA-NMBC08497L-3,14-dihydroxy-N-(cyclobutylmethyl)morphinanL001244

Database identifiers

PubChem CID
2487
DTXSID
DTXSID70860592

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
43.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
24

Related reactions

1 records
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Compound notes

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