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289725-61-7 | 2-Pyrrolidinecarboxamide, 1-formyl-N-1-naphthalenyl-, (2S)-
CAS No: 289725-61-7 Catalog No: AG002V1T MDL No:
Product Description
Catalog Number:
AG002V1T
Chemical Name:
2-Pyrrolidinecarboxamide, 1-formyl-N-1-naphthalenyl-, (2S)-
CAS Number:
289725-61-7
Molecular Formula:
C16H16N2O2
Molecular Weight:
268.3104
IUPAC Name:
(2S)-1-formyl-N-naphthalen-1-ylpyrrolidine-2-carboxamide
InChI:
InChI=1S/C16H16N2O2/c19-11-18-10-4-9-15(18)16(20)17-14-8-3-6-12-5-1-2-7-13(12)14/h1-3,5-8,11,15H,4,9-10H2,(H,17,20)/t15-/m0/s1
InChI Key:
MOIJXKYGDWLHLY-HNNXBMFYSA-N
SMILES:
O=CN1CCC[C@H]1C(=O)Nc1cccc2c1cccc2
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
268.121g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
268.316g/mol
Monoisotopic Mass:
268.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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