CID 26192431
PubChem CID
26192431
Structure
Molecular Formula
Status
Non-live
Molecular Weight
256.36 g/mol
Dates
- Create:2009-05-28
Chemical Structure Depiction
(3R)-3-(2-naphthalen-2-yloxyethyl)piperidin-1-ium
InChI=1S/C17H21NO/c1-2-6-16-12-17(8-7-15(16)5-1)19-11-9-14-4-3-10-18-13-14/h1-2,5-8,12,14,18H,3-4,9-11,13H2/p+1/t14-/m1/s1
ZWOFPTCLPBLWBL-CQSZACIVSA-O
C1C[C@@H](C[NH2+]C1)CCOC2=CC3=CC=CC=C3C=C2
C17H22NO+
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
256.36 g/mol
Property Name
XLogP3-AA
Property Value
3.8
Property Name
Hydrogen Bond Donor Count
Property Value
1
Property Name
Hydrogen Bond Acceptor Count
Property Value
1
Property Name
Rotatable Bond Count
Property Value
4
Property Name
Exact Mass
Property Value
256.170139325 g/mol
Property Name
Monoisotopic Mass
Property Value
256.170139325 g/mol
Property Name
Topological Polar Surface Area
Property Value
25.8 A^2
Property Name
Heavy Atom Count
Property Value
19
Property Name
Formal Charge
Property Value
1
Property Name
Complexity
Property Value
268
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
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
CONTENTS