基本情報
- 標準SMILES
CNC(C)CC1CCCCC1- InChIKey
JCRIVQIOJSSCQD-UHFFFAOYSA-N- 分子式
- C10H21N
- 平均分子量
- 155.28 g/mol
- 単同位体質量
- 155.16739967
名称と識別子
- 優先名称
- Propylhexedrine
- IUPAC
- 1-cyclohexyl-N-methylpropan-2-amine
- 現地名
- プロピルヘキセドリン
- 英語名
- N,alpha-dimethylcyclohexaneethylamine
- 分子式
- C10H21N
- 分子量
- 155.28
名称と別名
PropylhexedrineBenzedrexHydromethamphetamineDristan Inhaler101-40-61-cyclohexyl-N-methylpropan-2-aminePropilhexedrinaPropylhexadrinePropylhexedrinumDL-propylhexedrine1-Cyclohexyl-2-(methylamino)propanePropilesedrina
名称をさらに表示
N-メチル-3-シクロヘキシルプロパン-2-アミンドリスタンインハレルドリスタンインヘイラーベンヘラー1-シクロヘキシル-2-(メチルアミノ)プロパンベンゼドレックスプロピルヘキセドリンα,N-ジメチルシクロヘキサンエタンアミンベンゼドレキスN,α-ジメチルシクロヘキサンエタンアミン(1-シクロヘキシルプロパン-2-イル)(メチル)アミンChp-depotHexahydrodesoxyephedrineCyclohexaneethanamine, N,α-dimethyl-N,alpha-dimethylcyclohexaneethylamine(2-Cyclohexyl-1-methylethyl)methylamine
Methyl-(1-methyl-2-cyclohexylethyl)amineLQU92IU8LLNSC-32410(1-cyclohexylpropan-2-yl)(methyl)amine(+-)-N,alpha-DimethylcyclohexaneethylamineNSC32410Propylhexedrine dl-Cyclohexaneethanamine, N,alpha-dimethyl-
データベース識別子
- CAS
101-40-6、3595-11-7- PubChem CID
- 7558
- DTXSID
DTXSID1023526- ChEMBL
CHEMBL2105275- ChEBI
CHEBI:134783- UNII
- LQU92IU8LL
- EC Number
- 202-939-3、222-741-0
- Nikkaji
- J21.261J
物性
構造計算による物性
- XLogP
- 3.5
- 極性表面積
- 12 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 1
- 回転可能結合数
- 3
- 重原子数
- 11
- 形式電荷
- 0
- 複雑度
- 95
実験および物理化学的性質
Physical DescriptionSolid
Kovats Retention Index
1170；1210；1185；1160；1176.2；1169
1179；1179；1161.7；1166.2；1157；1187；1193；1200
1410；1421；1431
物理化学的性質
- 沸点
- 209.13 °C · 209.13°C (estimate)
- 比重(密度)
- 0.8501 · 0.8501
- 屈折率
- 1.46 · 1.4600
- 酸解離定数(Pka)
- 10.78 · 10.78±0.10(Predicted)
安全と法規制
GHS分類
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
危険有害性情報
Regulatory InformationCyclohexaneethanamine, N,.alpha.-dimethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesAcute Tox. 3 (100%)
法規制情報
Regulatory InformationCyclohexaneethanamine, N,.alpha.-dimethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
安全データ
- hazard_class
- IRRITANT
化学と産業
薬理情報
Pharmacodynamics
Like other monoamine releasing stimulants propylhexedrine is active as a norepinephrine and dopamine releaser in the central nervous system. The acute effects of the drug closely resemble the physiological and psychological effects of an epinephrine-provoked fight-or-flight response, including increased heart rate and blood pressure, vasoconstriction (constriction of the arterial walls), bronchodilation, and hyperglycemia (increased blood sugar).
Mechanism of Action
Propylhexidrine causes the norepinephrine, dopamine, and serotonin (5HT) transporters to reverse their direction of flow. This inversion leads to a release of these transmitters from the vesicles to the cytoplasm and from the cytoplasm to the synapse. It also antagonizes the action of VMAT2, causing the release of more neurotransmitters.
Cellular LocationsCytoplasm；Membrane
用途と製造
Use ClassificationPharmaceuticals
応用分野
使用Adrenergic (vasoconstrictor).
上流・下流製品情報
上流原料
下流製品
関連反応
5 件
関連ノート
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