2-(2-Fluoro-phenyl)-1-pyridin-3-yl-ethylamine

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Basic information

CAS: 958033-37-9
Standard SMILES: NC(Cc1ccccc1F)c1cccnc1
InChIKey: UUMPGRZUCGEKSO-UHFFFAOYSA-N
Molecular formula: C13H13FN2
Average molar mass: 216.25 g/mol
Monoisotopic mass: 216.10627659

Names & identifiers

Preferred name: 2-(2-Fluoro-phenyl)-1-pyridin-3-yl-ethylamine
IUPAC: 2-(2-fluorophenyl)-1-pyridin-3-ylethanamine

Names & synonyms

2-(2-fluoro-phenyl)-1-pyridin-3-yl-ethylamineSCHEMBL3281088UUMPGRZUCGEKSO-UHFFFAOYSA-NDTXSID101238093958033-37-92-(2-Fluorophenyl)-1-(pyridin-3-yl)ethan-1-amineI+/--[(2-Fluorophenyl)methyl]-3-pyridinemethanamine

Database identifiers

CAS: 958033-37-9
PubChem CID: 22299528
DTXSID: DTXSID101238093

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 38.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 16
Formal charge: 0
Complexity: 210

Related reactions

1 records

New reaction record

HRID 2233418As productuspto-grants-2010_05

Compound notes

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