CID 47205591
PubChem CID
47205591
Structure
Molecular Formula
Status
Non-live
Molecular Weight
273.33 g/mol
Dates
- Create:2010-11-26
Chemical Structure Depiction
2-imidazol-1-yl-N-[2-(4-methylphenoxy)ethyl]propanamide
InChI=1S/C15H19N3O2/c1-12-3-5-14(6-4-12)20-10-8-17-15(19)13(2)18-9-7-16-11-18/h3-7,9,11,13H,8,10H2,1-2H3,(H,17,19)
QVANURBCJDBFDU-UHFFFAOYSA-N
CC1=CC=C(C=C1)OCCNC(=O)C(C)N2C=CN=C2
C15H19N3O2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
273.33 g/mol
Property Name
XLogP3-AA
Property Value
1.9
Property Name
Hydrogen Bond Donor Count
Property Value
1
Property Name
Hydrogen Bond Acceptor Count
Property Value
3
Property Name
Rotatable Bond Count
Property Value
6
Property Name
Exact Mass
Property Value
273.147726857 g/mol
Property Name
Monoisotopic Mass
Property Value
273.147726857 g/mol
Property Name
Topological Polar Surface Area
Property Value
56.2 A^2
Property Name
Heavy Atom Count
Property Value
20
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
303
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
1
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