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Home > Indoles and Oxindole > 1786495-37-1
1786495-37-1 | (R)-2-(Piperidin-3-yl)isoindolin-1-one
CAS No: 1786495-37-1 Catalog No: AG01EUE8 MDL No:
Product Description
Catalog Number:
AG01EUE8
Chemical Name:
(R)-2-(Piperidin-3-yl)isoindolin-1-one
CAS Number:
1786495-37-1
Molecular Formula:
C13H16N2O
Molecular Weight:
216.2789
IUPAC Name:
2-[(3R)-piperidin-3-yl]-3H-isoindol-1-one
InChI:
InChI=1S/C13H16N2O/c16-13-12-6-2-1-4-10(12)9-15(13)11-5-3-7-14-8-11/h1-2,4,6,11,14H,3,5,7-9H2/t11-/m1/s1
InChI Key:
ZYCVDGADEULRSM-LLVKDONJSA-N
SMILES:
O=C1N(Cc2c1cccc2)[C@@H]1CCCNC1
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
216.126g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.284g/mol
Monoisotopic Mass:
216.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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