CID 44397528
PubChem CID
44397528
Structure
Molecular Formula
Status
Non-live
Molecular Weight
235.73 g/mol
Dates
- Create:2009-11-19
Chemical Structure Depiction
3-[[(2R)-pyrrolidin-2-yl]methyl]-1H-indole;chloride
InChI=1S/C13H16N2.ClH/c1-2-6-13-12(5-1)10(9-15-13)8-11-4-3-7-14-11;/h1-2,5-6,9,11,14-15H,3-4,7-8H2;1H/p-1/t11-;/m1./s1
KUOZRHKNZSRHIK-RFVHGSKJSA-M
C1C[C@@H](NC1)CC2=CNC3=CC=CC=C32.[Cl-]
C13H16ClN2-
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
235.73 g/mol
Property Name
Hydrogen Bond Donor Count
Property Value
2
Property Name
Hydrogen Bond Acceptor Count
Property Value
2
Property Name
Rotatable Bond Count
Property Value
2
Property Name
Exact Mass
Property Value
235.1002012 g/mol
Property Name
Monoisotopic Mass
Property Value
235.1002012 g/mol
Property Name
Topological Polar Surface Area
Property Value
27.8 A^2
Property Name
Heavy Atom Count
Property Value
16
Property Name
Formal Charge
Property Value
-1
Property Name
Complexity
Property Value
217
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
1
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
2
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
Old substance
Old substance
CONTENTS