CID 39382028
PubChem CID
39382028
Structure
Molecular Formula
Status
Non-live
Molecular Weight
282.35 g/mol
Dates
- Create:2009-05-29
Chemical Structure Depiction
(2R)-2-(3-fluoroanilino)-N-(3-propan-2-yloxypropyl)propanamide
InChI=1S/C15H23FN2O2/c1-11(2)20-9-5-8-17-15(19)12(3)18-14-7-4-6-13(16)10-14/h4,6-7,10-12,18H,5,8-9H2,1-3H3,(H,17,19)/t12-/m1/s1
ZAGVRBIMDZVYGN-GFCCVEGCSA-N
C[C@H](C(=O)NCCCOC(C)C)NC1=CC(=CC=C1)F
C15H23FN2O2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
282.35 g/mol
Property Name
XLogP3-AA
Property Value
2.8
Property Name
Hydrogen Bond Donor Count
Property Value
2
Property Name
Hydrogen Bond Acceptor Count
Property Value
4
Property Name
Rotatable Bond Count
Property Value
8
Property Name
Exact Mass
Property Value
282.17435614 g/mol
Property Name
Monoisotopic Mass
Property Value
282.17435614 g/mol
Property Name
Topological Polar Surface Area
Property Value
50.4 A^2
Property Name
Heavy Atom Count
Property Value
20
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
287
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
1
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