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20984-63-8 | 1-Pyrrolidinecarboxamide, 3-(methylphenylamino)-
CAS No: 20984-63-8 Catalog No: AG002KFR MDL No:
Product Description
Catalog Number:
AG002KFR
Chemical Name:
1-Pyrrolidinecarboxamide, 3-(methylphenylamino)-
CAS Number:
20984-63-8
Molecular Formula:
C12H17N3O
Molecular Weight:
219.2829
IUPAC Name:
3-(N-methylanilino)pyrrolidine-1-carboxamide
InChI:
InChI=1S/C12H17N3O/c1-14(10-5-3-2-4-6-10)11-7-8-15(9-11)12(13)16/h2-6,11H,7-9H2,1H3,(H2,13,16)
InChI Key:
SUQQLZPSVUGFFH-UHFFFAOYSA-N
SMILES:
NC(=O)N1CCC(C1)N(c1ccccc1)C
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.137g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.288g/mol
Monoisotopic Mass:
219.137g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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