Home Other Building Blocks 2-(3-methoxyphenyl)-1-(piperazin-1-yl)ethan-1-one

2-(3-methoxyphenyl)-1-(piperazin-1-yl)ethan-1-one

CAS No.:
926254-27-5
Catalog Number:
AG019Y04
Molecular Formula:
C13H18N2O2
Molecular Weight:
234.2942
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Product Description
Catalog Number:
AG019Y04
Chemical Name:
2-(3-methoxyphenyl)-1-(piperazin-1-yl)ethan-1-one
CAS Number:
926254-27-5
Molecular Formula:
C13H18N2O2
Molecular Weight:
234.2942
MDL Number:
MFCD08442331
IUPAC Name:
2-(3-methoxyphenyl)-1-piperazin-1-ylethanone
InChI:
InChI=1S/C13H18N2O2/c1-17-12-4-2-3-11(9-12)10-13(16)15-7-5-14-6-8-15/h2-4,9,14H,5-8,10H2,1H3
InChI Key:
PFFDWHCBSKJONS-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)CC(=O)N1CCNCC1
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.137g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.299g/mol
Monoisotopic Mass:
234.137g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties