N-(2-Chloro-6-((3-(hydroxymethyl)pyrrolidin-1-yl)methyl)pyridin-3-yl)pivalamide , CAS No.1203499-44-8

CAS: 1203499-44-8 Cat. No.: N166454 Molecular Weight: 325.83 PubChem CID: 46737899
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Synonyms
MFCD13176632 | N-(2-chloro-6-{[3-(hydroxymethyl)pyrrolidin-1-yl]methyl}pyridin-3-yl)-2,2-dimethylpropanamide | N-(2-CHLORO-6-((3-(HYDROXYMETHYL)PYRROLIDIN-1-YL)-METHYL)PYRIDIN-3-YL)PIVALAMIDE | N-(2-Chloro-6-((3-(hydroxymethyl)pyrrolidin-1-yl)methyl)pyrid
Storage
Room temperature
Shipped In
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N166454-1g
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Why this grade

for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
MFCD13176632 | N-(2-chloro-6-{[3-(hydroxymethyl)pyrrolidin-1-yl]methyl}pyridin-3-yl)-2, 2-dimethylpropanamide | N-(2-CHLORO-6-((3-(HYDROXYMETHYL)PYRROLIDIN-1-YL)-METHYL)PYRIDIN-3-YL)PIVALAMIDE | N-(2-Chloro-6-((3-(hydroxymethyl)pyrrolidin-1-yl)methyl)pyrid
Storage
Room temperature
Shipped In
Normal
Names and Identifiers
Canonical SmilesCC(C)(C)C(=O)NC1=C(N=C(C=C1)CN2CCC(C2)CO)Cl
IUPAC NameN-[2-chloro-6-[[3-(hydroxymethyl)pyrrolidin-1-yl]methyl]pyridin-3-yl]-2,2-dimethylpropanamide
InChIKeyKAPXUZRLJJZKPJ-UHFFFAOYSA-N
INCHI1S/C16H24ClN3O2/c1-16(2,3)15(22)19-13-5-4-12(18-14(13)17)9-20-7-6-11(8-20)10-21/h4-5,11,21H,6-10H2,1-3H3,(H,19,22)
Isomeric SMILES CC(C)(C)C(=O)NC1=C(N=C(C=C1)CN2CCC(C2)CO)Cl
WGK Germany 3
PubChem CID 46737899
Molecular Weight 325.83

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

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✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassPyridines and derivatives
Subclass2-pyridylmethylamines
Intermediate Tree Nodes Not available
Direct Parent6-substituted-2-pyridinylmethylamines
Alternative Parents N-arylamides  2-halopyridines  Aralkylamines  N-alkylpyrrolidines  Aryl chlorides  1,3-aminoalcohols  Heteroaromatic compounds  Trialkylamines  Secondary carboxylic acid amides  Amino acids and derivatives  Azacyclic compounds  Carbonyl compounds  Hydrocarbon derivatives  Organic oxides  Organochlorides  Primary alcohols  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents 6-substituted-2-pyridinylmethylamine - N-arylamide - 2-halopyridine - Aralkylamine - Aryl chloride - Aryl halide - N-alkylpyrrolidine - 1,3-aminoalcohol - Heteroaromatic compound - Pyrrolidine - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organooxygen compound - Primary alcohol - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as 6-substituted-2-pyridinylmethylamines. These are aromatic heterocyclic compounds contaning a pyridine ring which is substituted at the 2-position with a methylamine, and at the 6-position with any non-hydrogen atom.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight325.830 g/mol
XLogP32.000
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass325.156 Da
Monoisotopic Mass325.156 Da
Topological Polar Surface Area65.500 Ų
Heavy Atom Count22
Formal Charge0
Complexity386.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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