CID 25873476
PubChem CID
25873476
Structure
Molecular Formula
Status
Non-live
Molecular Weight
259.32 g/mol
Dates
- Create:2009-05-27
Chemical Structure Depiction
[4-(2-hydroxyethoxy)phenyl]methyl-(pyridin-2-ylmethyl)azanium
InChI=1S/C15H18N2O2/c18-9-10-19-15-6-4-13(5-7-15)11-16-12-14-3-1-2-8-17-14/h1-8,16,18H,9-12H2/p+1
JLAWKTYZYBUEKH-UHFFFAOYSA-O
C1=CC=NC(=C1)C[NH2+]CC2=CC=C(C=C2)OCCO
C15H19N2O2+
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
259.32 g/mol
Property Name
XLogP3-AA
Property Value
1
Property Name
Hydrogen Bond Donor Count
Property Value
2
Property Name
Hydrogen Bond Acceptor Count
Property Value
3
Property Name
Rotatable Bond Count
Property Value
7
Property Name
Exact Mass
Property Value
259.144652853 g/mol
Property Name
Monoisotopic Mass
Property Value
259.144652853 g/mol
Property Name
Topological Polar Surface Area
Property Value
59 A^2
Property Name
Heavy Atom Count
Property Value
19
Property Name
Formal Charge
Property Value
1
Property Name
Complexity
Property Value
230
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
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
Old substance
CONTENTS