CID 47256446
PubChem CID
47256446
Structure
Molecular Formula
Status
Non-live
Molecular Weight
277.36 g/mol
Dates
- Create:2010-11-26
Chemical Structure Depiction
N-benzyl-2-[[2-(ethylamino)-2-oxoethyl]-methylamino]propanamide
InChI=1S/C15H23N3O2/c1-4-16-14(19)11-18(3)12(2)15(20)17-10-13-8-6-5-7-9-13/h5-9,12H,4,10-11H2,1-3H3,(H,16,19)(H,17,20)
GIYJMLRNIKEOIA-UHFFFAOYSA-N
CCNC(=O)CN(C)C(C)C(=O)NCC1=CC=CC=C1
C15H23N3O2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
277.36 g/mol
Property Name
XLogP3-AA
Property Value
1.2
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
277.17902698 g/mol
Property Name
Monoisotopic Mass
Property Value
277.17902698 g/mol
Property Name
Topological Polar Surface Area
Property Value
61.4 A^2
Property Name
Heavy Atom Count
Property Value
20
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
314
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