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N-Methylpyrazole-4-carboxamide

CAT: 1459-CS-O-15650Size: 1 EachDry Ice: NoHazardous: No
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Description
N-Methylpyrazole-4-carboxamide is listed under Metabolite and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Regadenoson. The product is supplied by Clearsynth under CAT No. CS-O-15650. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
1154383-52-4
Synonyms
N-Methylpyrazole-4-carboxamide
Molecular Formula
C 5 H 7 N 3 O
Molecular Weight
125.13
Additionnal Information
N-Methylpyrazole-4-carboxamide is supplied with detailed characterization data compliant with regulatory guideline. N-Methylpyrazole-4-carboxamide can be used for analytical method development, method validation (AMV), Quality Control (QC) application for Abbreviated New Drug Application (ANDA), or during commercial production of Regadenoson.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

N-Methyl-1H-pyrazole-4-carboxamide
CAS Number1154383-52-4
PubChem CID43582329
IUPAC NameN-methyl-1H-pyrazole-4-carboxamide
Molecular FormulaC5H7N3O
Molecular Weight125.13
XLogP-0.5
Topological Polar Surface Area57.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity115
SMILES
CNC(=O)C1=CNN=C1
InChI
InChI=1S/C5H7N3O/c1-6-5(9)4-2-7-8-3-4/h2-3H,1H3,(H,6,9)(H,7,8)
InChIKey
KYHLCISBAUJJDH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Methyl-1H-pyrazole-4-carboxamide
CAS: 1154383-52-4
CID: 43582329
Formula: C5H7N3O
MW: 125.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight125.13
XLogP3-0.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass125.058911855
Monoisotopic Mass125.058911855
Topological Polar Surface Area57.8 Ų
Heavy Atom Count9
Formal Charge0
Complexity115
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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