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1008220-64-1 | 2,5-Pyrrolidinedione, 3-(cyclopropylamino)-1-(4-methylphenyl)-
CAS No: 1008220-64-1 Catalog No: AG0002Y5 MDL No:MFCD02041718
Product Description
Catalog Number:
AG0002Y5
Chemical Name:
2,5-Pyrrolidinedione, 3-(cyclopropylamino)-1-(4-methylphenyl)-
CAS Number:
1008220-64-1
Molecular Formula:
C14H16N2O2
Molecular Weight:
244.2890
MDL Number:
MFCD02041718
IUPAC Name:
3-(cyclopropylamino)-1-(4-methylphenyl)pyrrolidine-2,5-dione
InChI:
InChI=1S/C14H16N2O2/c1-9-2-6-11(7-3-9)16-13(17)8-12(14(16)18)15-10-4-5-10/h2-3,6-7,10,12,15H,4-5,8H2,1H3
InChI Key:
PTNVQUCRQHQMJM-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)N1C(=O)CC(C1=O)NC1CC1
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.294g/mol
Monoisotopic Mass:
244.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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