CID 51260489
PubChem CID
51260489
Structure
Molecular Formula
Status
Non-live
Molecular Weight
351.5 g/mol
Dates
- Create:2011-05-03
Chemical Structure Depiction
2-[(4-fluorophenyl)methyl-methylamino]-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]acetamide
InChI=1S/C19H30FN3O2/c1-15(2)11-23-8-9-25-18(13-23)10-21-19(24)14-22(3)12-16-4-6-17(20)7-5-16/h4-7,15,18H,8-14H2,1-3H3,(H,21,24)
RXKNWJWPNDBWSR-UHFFFAOYSA-N
CC(C)CN1CCOC(C1)CNC(=O)CN(C)CC2=CC=C(C=C2)F
C19H30FN3O2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
351.5 g/mol
Property Name
XLogP3-AA
Property Value
2.3
Property Name
Hydrogen Bond Donor Count
Property Value
1
Property Name
Hydrogen Bond Acceptor Count
Property Value
5
Property Name
Rotatable Bond Count
Property Value
8
Property Name
Exact Mass
Property Value
351.23220537 g/mol
Property Name
Monoisotopic Mass
Property Value
351.23220537 g/mol
Property Name
Topological Polar Surface Area
Property Value
44.8 A^2
Property Name
Heavy Atom Count
Property Value
25
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
400
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
Old substance
Old substance
CONTENTS