Home Aminos 3-amino-1-[(4-methoxyphenyl)methyl]pyrrolidin-2-one

3-amino-1-[(4-methoxyphenyl)methyl]pyrrolidin-2-one

CAS No.:
1248990-38-6
Catalog Number:
AG01AITH
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
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Product Description
Catalog Number:
AG01AITH
Chemical Name:
3-amino-1-[(4-methoxyphenyl)methyl]pyrrolidin-2-one
CAS Number:
1248990-38-6
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
MDL Number:
MFCD14689518
IUPAC Name:
3-amino-1-[(4-methoxyphenyl)methyl]pyrrolidin-2-one
InChI:
InChI=1S/C12H16N2O2/c1-16-10-4-2-9(3-5-10)8-14-7-6-11(13)12(14)15/h2-5,11H,6-8,13H2,1H3
InChI Key:
HAGJMFSHYXVTPW-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CN1CCC(C1=O)N
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.121g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.272g/mol
Monoisotopic Mass:
220.121g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties