N-(5-amino-2-chloro-3-pyridinyl)methanesulfonamide (HCID 71480920)

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Basic information

Standard SMILES: CS(=O)(=O)Nc1cc(N)cnc1Cl
InChIKey: HVMMVJGMZYCVNZ-UHFFFAOYSA-N
Molecular formula: C6H8ClN3O2S
Average molar mass: 221.67 g/mol

Names & identifiers

Preferred name: N-(5-amino-2-chloro-3-pyridinyl)methanesulfonamide
IUPAC: N-(5-amino-2-chloro-3-pyridinyl)methanesulfonamide

Names & synonyms

N-(5-amino-2-chloro-3-pyridinyl)methanesulfonamideSCHEMBL115870HVMMVJGMZYCVNZ-UHFFFAOYSA-NDB-188485N-(5-amino-2-chloropyridin-3-yl)methanesulfonamide1253576-93-0

Database identifiers

PubChem CID: 71480920

Properties

Computed structural properties

XLogP: 0.1
Topological polar surface area: 93.5 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 2
Heavy atoms: 13
Formal charge: 0
Complexity: 264

Related reactions

28 records

New reaction record

HRID 98280As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 105858As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 301561As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

HRID 939298As reactantValidation data from https://doi.org/10.1039/C8SC04228D

HRID 950662As reactantValidation data from https://doi.org/10.1039/C8SC04228D

HRID 1218279As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

HRID 1551938As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

HRID 1621876As reactantuspto-grants-2014_07

Compound notes

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