NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3-{[(cyclohexylmethyl)amino]methyl}-3-hydroxy-1-(3-phenylpropyl)piperidin-2-one
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IUPAC Traditional name
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3-{[(cyclohexylmethyl)amino]methyl}-3-hydroxy-1-(3-phenylpropyl)piperidin-2-one
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Synonyms
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3-{[(cyclohexylmethyl)amino]methyl}-3-hydroxy-1-(3-phenylpropyl)piperidin-2-one
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
Acid pKa
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12.465985
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H Acceptors
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3
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H Donor
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2
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LogD (pH = 5.5)
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0.30155104
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LogD (pH = 7.4)
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1.2190837
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Log P
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3.5011103
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Molar Refractivity
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105.6505 cm3
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Polarizability
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41.69743 Å3
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Polar Surface Area
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52.57 Å2
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Rotatable Bonds
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8
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Lipinski's Rule of Five
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true
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H Acceptors
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3
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H Donor
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2
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Log P
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3.79
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LOG S
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-5.05
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Polar Surface Area
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52.57 Å2
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Rotatable Bonds
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8
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent