Home Aminos 1-[3-(1-aminoethyl)phenyl]pyrrolidin-2-one

1-[3-(1-aminoethyl)phenyl]pyrrolidin-2-one

CAS No.:
1258652-26-4
Catalog Number:
AG019Y2V
Molecular Formula:
C12H16N2O
Molecular Weight:
204.2682
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Product Description
Catalog Number:
AG019Y2V
Chemical Name:
1-[3-(1-aminoethyl)phenyl]pyrrolidin-2-one
CAS Number:
1258652-26-4
Molecular Formula:
C12H16N2O
Molecular Weight:
204.2682
MDL Number:
MFCD17167109
IUPAC Name:
1-[3-(1-aminoethyl)phenyl]pyrrolidin-2-one
InChI:
InChI=1S/C12H16N2O/c1-9(13)10-4-2-5-11(8-10)14-7-3-6-12(14)15/h2,4-5,8-9H,3,6-7,13H2,1H3
InChI Key:
PHDOEZIQADMSJW-UHFFFAOYSA-N
SMILES:
O=C1CCCN1c1cccc(c1)C(N)C
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.126g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.273g/mol
Monoisotopic Mass:
204.126g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties