4-Isopropyl-N-(4-morpholinyl)benzamide

Base Information

• Chemical Name: 4-Isopropyl-N-(4-morpholinyl)benzamide
• CAS No.: 544659-84-9
• Molecular Formula: C14H20N2O2
• Molecular Weight: 248.3208
• DSSTox Substance ID: DTXSID10399210
• Wikidata: Q82201610
• ChEMBL ID: CHEMBL1458500
• Mol file: 544659-84-9.mol

Synonyms:544659-84-9;HMS2997L14;4-Isopropyl-N-(4-morpholinyl)benzamide;ST50929290;MLS001224441;CHEMBL1458500;SCHEMBL14441141;DTXSID10399210;STK459259;AKOS003287965;SMR000679644;N-(morpholin-4-yl)-4-(propan-2-yl)benzamide

Chemical Property of 4-Isopropyl-N-(4-morpholinyl)benzamide

Chemical Property:

• PKA: 12.17±0.20(Predicted)
• PSA: 41.57000
• Density: 1.12±0.1 g/cm3(Predicted)
• LogP: 2.11580
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 248.152477885
• Heavy Atom Count: 18
• Complexity: 267

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=CC=C(C=C1)C(=O)NN2CCOCC2