CID 47412582
PubChem CID
47412582
Structure
Molecular Formula
Status
Non-live
Molecular Weight
278.35 g/mol
Dates
- Create:2010-11-26
Chemical Structure Depiction
N-[2-[methyl-[2-(2-methylphenoxy)ethyl]amino]-2-oxoethyl]propanamide
InChI=1S/C15H22N2O3/c1-4-14(18)16-11-15(19)17(3)9-10-20-13-8-6-5-7-12(13)2/h5-8H,4,9-11H2,1-3H3,(H,16,18)
FHWWKNVCJBRODQ-UHFFFAOYSA-N
CCC(=O)NCC(=O)N(C)CCOC1=CC=CC=C1C
C15H22N2O3
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
278.35 g/mol
Property Name
XLogP3-AA
Property Value
1.6
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
7
Property Name
Exact Mass
Property Value
278.16304257 g/mol
Property Name
Monoisotopic Mass
Property Value
278.16304257 g/mol
Property Name
Topological Polar Surface Area
Property Value
58.6 A^2
Property Name
Heavy Atom Count
Property Value
20
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
320
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
CONTENTS