2-cyano-N-(4-methoxyphenyl)acetamide 2-氰基-N-(4-甲氧基苯基)乙酰胺

CAS 5382-38-7 MFCD00214717

化学结构图

5382-38-7
SMILES: COc1ccc(NC(=O)CC#N)cc1

化学属性

Mol. FormulaC10H10N2O2
Mol. Weight190.20
Melting Point133-135 °C

别名和识别编码

Chemical Name2-Cyano-N-(4-methoxyphenyl)acetamide
CAS Number5382-38-7
Alfabeta NameCYANOMETHOXYPHENYLACETAMIDE N24()----
MDL NumberMFCD00214717
Chemical Name Translation2-氰基-N-(4-甲氧基苯基)乙酰胺
InChIKeyVFDUTASVNHKUJM-UHFFFAOYSA-N
LabNetwork Molecule IDLN00147515
Synonym 2-Cyano-N-(4-methoxyphenyl)acetamide {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {} {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {} {} {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {} {} {} {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {} {} {} {} {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {} {} {} {} {} {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {} {} {} {} {} {} {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetamide {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Cyano-N-(4-methoxyphenyl)acetam
Canonical SMILESCOC1=CC=C(C=C1)NC(=O)CC#N
PubChem Substance ID79343
InChIInChI=1S/C10H10N2O2/c1-14-9-4-2-8(3-5-9)12-10(13)6-7-11/h2-5H,6H2,1H3,(H,12,13)
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分类

  • {KO} Nitriles

安全信息

Warnings IRRITANT
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 Donors
1
H-bond Acceptors
3
Rotatable Bonds
3
LogP
6.688000000000000e-001

系列性分类

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