n-[(5-Chlorothiophen-2-yl)methyl]pyridin-2-amine

HCID 273615

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Basic information

CAS: 90797-71-0
Standard SMILES: Clc1ccc(CNc2ccccn2)s1
InChIKey: OSACOEMXJXFBLV-UHFFFAOYSA-N
Molecular formula: C10H9ClN2S
Average molar mass: 224.71 g/mol
Monoisotopic mass: 224.0174972

Names & identifiers

Preferred name: n-[(5-Chlorothiophen-2-yl)methyl]pyridin-2-amine
IUPAC: N-[(5-chlorothiophen-2-yl)methyl]pyridin-2-amine

Names & synonyms

90797-71-0n-[(5-chlorothiophen-2-yl)methyl]pyridin-2-amineNSC118986SCHEMBL21048205DTXSID60297893NSC-118986N-[(5-chloro-2-thienyl)methyl]-2-pyridinamineZ636447806

Database identifiers

CAS: 90797-71-0
PubChem CID: 273615
DTXSID: DTXSID60297893

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 53.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 14
Formal charge: 0
Complexity: 180

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