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6192-97-8 molecular structure
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[(2S)-1-cyclohexylpropan-2-yl](methyl)amine

ChemBase ID: 128059
Molecular Formular: C10H21N
Molecular Mass: 155.28044
Monoisotopic Mass: 155.16739968
SMILES and InChIs

SMILES:
N([C@H](CC1CCCCC1)C)C
Canonical SMILES:
CN[C@H](CC1CCCCC1)C
InChI:
InChI=1S/C10H21N/c1-9(11-2)8-10-6-4-3-5-7-10/h9-11H,3-8H2,1-2H3/t9-/m0/s1
InChIKey:
JCRIVQIOJSSCQD-VIFPVBQESA-N

Cite this record

CBID:128059 http://www.chembase.cn/molecule-128059.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
[(2S)-1-cyclohexylpropan-2-yl](methyl)amine
IUPAC Traditional name
levopropylhexedrine
Synonyms
Levopropylhexedrine
CAS Number
6192-97-8
PubChem SID
162222375
PubChem CID
71197
Chemspider ID
64333
Unique Ingredient Identifier
4R3L4TYV09
Wikipedia Title
Levopropylhexedrine

DATA SOURCES

DATA SOURCES

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Data Source Data ID Price

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -0.53163725  LogD (pH = 7.4) -0.22243364 
Log P 2.7045949  Molar Refractivity 49.5352 cm3
Polarizability 19.986317 Å3 Polar Surface Area 12.03 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Pharmacology Properties Bioassay(PubChem)
Admin Routes
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Legal Status
Rx-only expand Show data source

DETAILS

DETAILS

Wikipedia Wikipedia

REFERENCES

REFERENCES

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PATENTS

PATENTS

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