(2-fluoro-1H-pyridin-2-yl)methanamine

C6H9FN2 — CID 69232547

IUPAC(2-fluoro-1H-pyridin-2-yl)methanamine
SMILESNCC1(F)C=CC=CN1
InChIInChI=1S/C6H9FN2/c7-6(5-8)3-1-2-4-9-6/h1-4,9H,5,8H2
InChIKeySCANHNZDKPAYCF-UHFFFAOYSA-N
MW128.15 g/mol
LogP0.28
Rot. Bonds1

About (2-fluoro-1H-pyridin-2-yl)methanamine

(2-fluoro-1H-pyridin-2-yl)methanamine (PubChem CID 69232547) has the molecular formula C6H9FN2 and a molecular weight of 128.15 g/mol. Its IUPAC name is (2-fluoro-1H-pyridin-2-yl)methanamine.

Molecular Properties

Compound Name(2-fluoro-1H-pyridin-2-yl)methanamine
PubChem CID69232547
Molecular FormulaC6H9FN2
Molecular Weight128.15 g/mol
Exact Mass128.07
IUPAC Name(2-fluoro-1H-pyridin-2-yl)methanamine
SMILESNCC1(F)C=CC=CN1
InChIInChI=1S/C6H9FN2/c7-6(5-8)3-1-2-4-9-6/h1-4,9H,5,8H2
InChIKeySCANHNZDKPAYCF-UHFFFAOYSA-N
XLogP0.28
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.15
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze (2-fluoro-1H-pyridin-2-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-1H-pyridin-2-yl)methanamine?
The IUPAC name of (2-fluoro-1H-pyridin-2-yl)methanamine (CID 69232547) is (2-fluoro-1H-pyridin-2-yl)methanamine.
What is the SMILES notation for (2-fluoro-1H-pyridin-2-yl)methanamine?
The canonical SMILES for (2-fluoro-1H-pyridin-2-yl)methanamine is NCC1(F)C=CC=CN1.
What is the InChIKey of (2-fluoro-1H-pyridin-2-yl)methanamine?
The InChIKey is SCANHNZDKPAYCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN2/c7-6(5-8)3-1-2-4-9-6/h1-4,9H,5,8H2.
What are the key properties of (2-fluoro-1H-pyridin-2-yl)methanamine?
(2-fluoro-1H-pyridin-2-yl)methanamine has a molecular weight of 128.15 g/mol, XLogP of 0.28, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-1H-pyridin-2-yl)methanamine is sourced from PubChem (CID 69232547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).