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4- (4-Aminophenoxy) -n-methylpicolinamide

CAT: 0013-GTR19250823-01Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19250823-01Size:500 mg
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Description
4- (4-Aminophenoxy) -n-methylpicolinamide
CAS Number
284462-37-9
Smiles
CNC (=O) C1=CC (OC2=CC=C (N) C=C2) =CC=N1
Molecular Formula
C13H13N3O2
Molecular Weight
243.26
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4-(4-Aminophenoxy)-N-methylpicolinamide
CAS Number284462-37-9
PubChem CID16655129
IUPAC Name4-(4-aminophenoxy)-N-methylpyridine-2-carboxamide
Molecular FormulaC13H13N3O2
Molecular Weight243.26
XLogP1.3
Topological Polar Surface Area77.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count18
Formal Charge0
Complexity277
SMILES
CNC(=O)C1=NC=CC(=C1)OC2=CC=C(C=C2)N
InChI
InChI=1S/C13H13N3O2/c1-15-13(17)12-8-11(6-7-16-12)18-10-4-2-9(14)3-5-10/h2-8H,14H2,1H3,(H,15,17)
InChIKey
RXZZBPYPZLAEFC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(4-Aminophenoxy)-N-methylpicolinamide
CAS: 284462-37-9
CID: 16655129
Formula: C13H13N3O2
MW: 243.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight243.26
XLogP31.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass243.100776666
Monoisotopic Mass243.100776666
Topological Polar Surface Area77.2 Ų
Heavy Atom Count18
Formal Charge0
Complexity277
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes