6-fluoro-N-prop-2-enylpyridin-2-amine

C8H9FN2 — CID 103624863

IUPAC6-fluoro-N-prop-2-enylpyridin-2-amine
SMILESC=CCNc1cccc(F)n1
InChIInChI=1S/C8H9FN2/c1-2-6-10-8-5-3-4-7(9)11-8/h2-5H,1,6H2,(H,10,11)
InChIKeyWFFARKQQQKENCG-UHFFFAOYSA-N
MW152.17 g/mol
LogP1.82
Rot. Bonds3

About 6-fluoro-N-prop-2-enylpyridin-2-amine

6-fluoro-N-prop-2-enylpyridin-2-amine (PubChem CID 103624863) has the molecular formula C8H9FN2 and a molecular weight of 152.17 g/mol. Its IUPAC name is 6-fluoro-N-prop-2-enylpyridin-2-amine.

Molecular Properties

Compound Name6-fluoro-N-prop-2-enylpyridin-2-amine
PubChem CID103624863
Molecular FormulaC8H9FN2
Molecular Weight152.17 g/mol
Exact Mass152.07
IUPAC Name6-fluoro-N-prop-2-enylpyridin-2-amine
SMILESC=CCNc1cccc(F)n1
InChIInChI=1S/C8H9FN2/c1-2-6-10-8-5-3-4-7(9)11-8/h2-5H,1,6H2,(H,10,11)
InChIKeyWFFARKQQQKENCG-UHFFFAOYSA-N
XLogP1.82
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.17
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 6-fluoro-N-prop-2-enylpyridin-2-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 6-fluoro-N-prop-2-enylpyridin-2-amine?
The IUPAC name of 6-fluoro-N-prop-2-enylpyridin-2-amine (CID 103624863) is 6-fluoro-N-prop-2-enylpyridin-2-amine.
What is the SMILES notation for 6-fluoro-N-prop-2-enylpyridin-2-amine?
The canonical SMILES for 6-fluoro-N-prop-2-enylpyridin-2-amine is C=CCNc1cccc(F)n1.
What is the InChIKey of 6-fluoro-N-prop-2-enylpyridin-2-amine?
The InChIKey is WFFARKQQQKENCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FN2/c1-2-6-10-8-5-3-4-7(9)11-8/h2-5H,1,6H2,(H,10,11).
What are the key properties of 6-fluoro-N-prop-2-enylpyridin-2-amine?
6-fluoro-N-prop-2-enylpyridin-2-amine has a molecular weight of 152.17 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-prop-2-enylpyridin-2-amine is sourced from PubChem (CID 103624863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).