2-(6-fluoro-3-pyridinyl)ethanamine

C7H9FN2 — CID 55253622

IUPAC2-(6-fluoro-3-pyridinyl)ethanamine
SMILESNCCc1ccc(F)nc1
InChIInChI=1S/C7H9FN2/c8-7-2-1-6(3-4-9)5-10-7/h1-2,5H,3-4,9H2
InChIKeyNMGFUUJOGIRMLR-UHFFFAOYSA-N
MW140.16 g/mol
LogP0.72
Rot. Bonds2

About 2-(6-fluoro-3-pyridinyl)ethanamine

2-(6-fluoro-3-pyridinyl)ethanamine (PubChem CID 55253622) has the molecular formula C7H9FN2 and a molecular weight of 140.16 g/mol. Its IUPAC name is 2-(6-fluoro-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(6-fluoro-3-pyridinyl)ethanamine
PubChem CID55253622
Molecular FormulaC7H9FN2
Molecular Weight140.16 g/mol
Exact Mass140.07
IUPAC Name2-(6-fluoro-3-pyridinyl)ethanamine
SMILESNCCc1ccc(F)nc1
InChIInChI=1S/C7H9FN2/c8-7-2-1-6(3-4-9)5-10-7/h1-2,5H,3-4,9H2
InChIKeyNMGFUUJOGIRMLR-UHFFFAOYSA-N
XLogP0.72
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.16
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-3-pyridinyl)ethanamine?
The IUPAC name of 2-(6-fluoro-3-pyridinyl)ethanamine (CID 55253622) is 2-(6-fluoro-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(6-fluoro-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(6-fluoro-3-pyridinyl)ethanamine is NCCc1ccc(F)nc1.
What is the InChIKey of 2-(6-fluoro-3-pyridinyl)ethanamine?
The InChIKey is NMGFUUJOGIRMLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9FN2/c8-7-2-1-6(3-4-9)5-10-7/h1-2,5H,3-4,9H2.
What are the key properties of 2-(6-fluoro-3-pyridinyl)ethanamine?
2-(6-fluoro-3-pyridinyl)ethanamine has a molecular weight of 140.16 g/mol, XLogP of 0.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-3-pyridinyl)ethanamine is sourced from PubChem (CID 55253622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).