3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine

C10H14FN3 — CID 68786672

IUPAC3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine
SMILESNC1(F)CC=CN=C1C1=CCNCC1
InChIInChI=1S/C10H14FN3/c11-10(12)4-1-5-14-9(10)8-2-6-13-7-3-8/h1-2,5,13H,3-4,6-7,12H2
InChIKeyOVXTYUXXYGRTIF-UHFFFAOYSA-N
MW195.24 g/mol
LogP0.89
Rot. Bonds1

About 3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine

3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine (PubChem CID 68786672) has the molecular formula C10H14FN3 and a molecular weight of 195.24 g/mol. Its IUPAC name is 3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine.

Molecular Properties

Compound Name3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine
PubChem CID68786672
Molecular FormulaC10H14FN3
Molecular Weight195.24 g/mol
Exact Mass195.12
IUPAC Name3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine
SMILESNC1(F)CC=CN=C1C1=CCNCC1
InChIInChI=1S/C10H14FN3/c11-10(12)4-1-5-14-9(10)8-2-6-13-7-3-8/h1-2,5,13H,3-4,6-7,12H2
InChIKeyOVXTYUXXYGRTIF-UHFFFAOYSA-N
XLogP0.89
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine 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 3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine?
The IUPAC name of 3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine (CID 68786672) is 3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine.
What is the SMILES notation for 3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine?
The canonical SMILES for 3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine is NC1(F)CC=CN=C1C1=CCNCC1.
What is the InChIKey of 3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine?
The InChIKey is OVXTYUXXYGRTIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3/c11-10(12)4-1-5-14-9(10)8-2-6-13-7-3-8/h1-2,5,13H,3-4,6-7,12H2.
What are the key properties of 3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine?
3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine has a molecular weight of 195.24 g/mol, XLogP of 0.89, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-(1,2,3,6-tetrahydropyridin-4-yl)-4H-pyridin-3-amine is sourced from PubChem (CID 68786672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).