4-(3-aminopropyl)-2,4-dihydro-3H-pyrazol-3-one 4-(3-aminopropyl)-2,4-dihydro-3H-pyrazol-3-one

CAS 7032-17-9 MFCD00053049

化学结构图

7032-17-9
SMILES: NCCCC1C=NNC1=O

化学属性

Mol. FormulaC6H11N3O
Mol. Weight141.17
Melting Point216 °C

别名和识别编码

Chemical Name4-(3-aminopropyl)-2,4-dihydro-3H-pyrazol-3-one
CAS Number7032-17-9
Alfabeta NameAMINOPROPYLDIHYDROPYRAZOLONE H432433()--------,
MDL NumberMFCD00053049
Chemical Name Translation4-(3-aminopropyl)-2,4-dihydro-3H-pyrazol-3-one
Synonym 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {} {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {} {} {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {} {} {} {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {} {} {} {} {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {} {} {} {} {} {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {} {} {} {} {} {} {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {} {} {} {} {} {} {} {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {} {} {} {} {} {} {} {} {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {} {} {} {} {} {} {} {} {} {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {} {} {} {} {} {} {} {} {} {} {} {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyrazol-5-one {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-(3-Aminopropyl)-4,5-dihydro-1h-pyra
LabNetwork Molecule IDLN00147690
PubChem Substance ID2776763
InChIInChI=1S/C6H11N3O/c7-3-1-2-5-4-8-9-6(5)10/h4-5H,1-3,7H2,(H,9,10)
Canonical SMILESO=C1NN=CC1CCCN
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分类

  • Building Blocks, C6, Chemical Synthesis, Heterocyclic Building Blocks, New Products for Chemical Synthesis, Pyrazoles
  • {KO} AminesPrimary

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Precautionary statements
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
Signal word Warning
Safety Statements
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
Hazard statements
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
Hazard Codes Xi
Risk Statements
  • R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
Storage condition

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Acceptors
3
Rotatable Bonds
3
H-bond Donors
2
LogP
-9.012000000000000e-001

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Pyrazoles 吡唑
  5. C6 - Pyrazoles

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