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5-Methylpyridine-2-carboxamide

CAT: 0926-VAA97077-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-VAA97077-01Size:50 mg
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CAS Number
20970-77-8
MDL Number
MFCD08062671
Molecular Formula
C7H8N2O
Molecular Weight
136.15 g/mol
Controlled
No

Chemical Information

5-Methylpyridine-2-carboxamide
CAS Number20970-77-8
PubChem CID12362937
IUPAC Name5-methylpyridine-2-carboxamide
Molecular FormulaC7H8N2O
Molecular Weight136.15
XLogP0.4
Topological Polar Surface Area56
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity136
SMILES
CC1=CN=C(C=C1)C(=O)N
InChI
InChI=1S/C7H8N2O/c1-5-2-3-6(7(8)10)9-4-5/h2-4H,1H3,(H2,8,10)
InChIKey
VFNBCOKXIDBFOC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Methylpyridine-2-carboxamide
CAS: 20970-77-8
CID: 12362937
Formula: C7H8N2O
MW: 136.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight136.15
XLogP30.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass136.063662883
Monoisotopic Mass136.063662883
Topological Polar Surface Area56 Ų
Heavy Atom Count10
Formal Charge0
Complexity136
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