3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine

C11H10FN3 — CID 50978797

IUPAC3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine
SMILESCc1ccc(-c2ccnc(F)c2)c(N)n1
InChIInChI=1S/C11H10FN3/c1-7-2-3-9(11(13)15-7)8-4-5-14-10(12)6-8/h2-6H,1H3,(H2,13,15)
InChIKeyOSEHNVIPHWSOCO-UHFFFAOYSA-N
MW203.22 g/mol
LogP2.17
Rot. Bonds1

About 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine

3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine (PubChem CID 50978797) has the molecular formula C11H10FN3 and a molecular weight of 203.22 g/mol. Its IUPAC name is 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine.

Molecular Properties

Compound Name3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine
PubChem CID50978797
Molecular FormulaC11H10FN3
Molecular Weight203.22 g/mol
Exact Mass203.09
IUPAC Name3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine
SMILESCc1ccc(-c2ccnc(F)c2)c(N)n1
InChIInChI=1S/C11H10FN3/c1-7-2-3-9(11(13)15-7)8-4-5-14-10(12)6-8/h2-6H,1H3,(H2,13,15)
InChIKeyOSEHNVIPHWSOCO-UHFFFAOYSA-N
XLogP2.17
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.22
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine?
The IUPAC name of 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine (CID 50978797) is 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine.
What is the SMILES notation for 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine?
The canonical SMILES for 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine is Cc1ccc(-c2ccnc(F)c2)c(N)n1.
What is the InChIKey of 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine?
The InChIKey is OSEHNVIPHWSOCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3/c1-7-2-3-9(11(13)15-7)8-4-5-14-10(12)6-8/h2-6H,1H3,(H2,13,15).
What are the key properties of 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine?
3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine has a molecular weight of 203.22 g/mol, XLogP of 2.17, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoro-4-pyridinyl)-6-methylpyridin-2-amine is sourced from PubChem (CID 50978797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).