Home Other Building Blocks 2-ethoxy-4-{octahydropyrrolo[1,2-a]piperazin-2-yl}aniline

2-ethoxy-4-{octahydropyrrolo[1,2-a]piperazin-2-yl}aniline

CAS No.:
1517701-00-6
Catalog Number:
AG01B16K
Molecular Formula:
C15H23N3O
Molecular Weight:
261.3626
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Product Description
Catalog Number:
AG01B16K
Chemical Name:
2-ethoxy-4-{octahydropyrrolo[1,2-a]piperazin-2-yl}aniline
CAS Number:
1517701-00-6
Molecular Formula:
C15H23N3O
Molecular Weight:
261.3626
MDL Number:
MFCD22895381
IUPAC Name:
4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-ethoxyaniline
InChI:
InChI=1S/C15H23N3O/c1-2-19-15-10-12(5-6-14(15)16)18-9-8-17-7-3-4-13(17)11-18/h5-6,10,13H,2-4,7-9,11,16H2,1H3
InChI Key:
GMWKJWUTBRPPKF-UHFFFAOYSA-N
SMILES:
CCOc1cc(ccc1N)N1CCN2C(C1)CCC2
Properties
Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.184g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
261.369g/mol
Monoisotopic Mass:
261.184g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
41.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties