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N-Methylpyrazine-2-carboxamide

CAT: 0127-OR1052675-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1052675-01Size:250 mg
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CAS Number
88393-94-6
MDL Number
MFCD13190391
Purity
95%
Smiles
O=C(C1=NC=CN=C1)NC

Chemical Information

N-methylpyrazine-2-carboxamide
CAS Number88393-94-6
PubChem CID470904
IUPAC NameN-methylpyrazine-2-carboxamide
Molecular FormulaC6H7N3O
Molecular Weight137.14
XLogP-0.2
Topological Polar Surface Area54.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity126
SMILES
CNC(=O)C1=NC=CN=C1
InChI
InChI=1S/C6H7N3O/c1-7-6(10)5-4-8-2-3-9-5/h2-4H,1H3,(H,7,10)
InChIKey
OPVFDBZMQPCJEB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-methylpyrazine-2-carboxamide
CAS: 88393-94-6
CID: 470904
Formula: C6H7N3O
MW: 137.14
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight137.14
XLogP3-0.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass137.058911855
Monoisotopic Mass137.058911855
Topological Polar Surface Area54.9 Ų
Heavy Atom Count10
Formal Charge0
Complexity126
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

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