NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-(3-{[(heptan-4-yl)amino]methyl}piperidin-1-yl)-2-methylpropan-1-one
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IUPAC Traditional name
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1-{3-[(heptan-4-ylamino)methyl]piperidin-1-yl}-2-methylpropan-1-one
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Synonyms
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N-[(1-isobutyryl-3-piperidinyl)methyl]-4-heptanamine
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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)
H Acceptors
|
2
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H Donor
|
1
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LogD (pH = 5.5)
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0.2748583
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LogD (pH = 7.4)
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0.45277798
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Log P
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3.5140667
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Molar Refractivity
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85.7537 cm3
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Polarizability
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34.05947 Å3
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Polar Surface Area
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32.34 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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2
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H Donor
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1
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Log P
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2.55
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LOG S
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-3.44
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Polar Surface Area
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32.34 Å2
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Rotatable Bonds
|
8
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent