CID 30057664
PubChem CID
30057664
Structure
Molecular Formula
Status
Non-live
Molecular Weight
291.39 g/mol
Dates
- Create:2009-05-28
Chemical Structure Depiction
(2S)-N-(3-amino-2-methylphenyl)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propanamide
InChI=1S/C16H25N3O2/c1-10-8-19(9-11(2)21-10)13(4)16(20)18-15-7-5-6-14(17)12(15)3/h5-7,10-11,13H,8-9,17H2,1-4H3,(H,18,20)/t10-,11-,13+/m1/s1
JOILNCORTJAJJN-WZRBSPASSA-N
C[C@@H]1CN(C[C@H](O1)C)[C@@H](C)C(=O)NC2=CC=CC(=C2C)N
C16H25N3O2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
291.39 g/mol
Property Name
XLogP3-AA
Property Value
1.7
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
3
Property Name
Exact Mass
Property Value
291.19467705 g/mol
Property Name
Monoisotopic Mass
Property Value
291.19467705 g/mol
Property Name
Topological Polar Surface Area
Property Value
67.6 A^2
Property Name
Heavy Atom Count
Property Value
21
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
353
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
3
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