2-fluoro-1-methyl-6-methylidenepyridine

C7H8FN — CID 142198451

IUPAC2-fluoro-1-methyl-6-methylidenepyridine
SMILESC=C1C=CC=C(F)N1C
InChIInChI=1S/C7H8FN/c1-6-4-3-5-7(8)9(6)2/h3-5H,1H2,2H3
InChIKeyJCSLAWRHNPROSM-UHFFFAOYSA-N
MW125.15 g/mol
LogP1.81
Rot. Bonds

About 2-fluoro-1-methyl-6-methylidenepyridine

2-fluoro-1-methyl-6-methylidenepyridine (PubChem CID 142198451) has the molecular formula C7H8FN and a molecular weight of 125.15 g/mol. Its IUPAC name is 2-fluoro-1-methyl-6-methylidenepyridine.

Molecular Properties

Compound Name2-fluoro-1-methyl-6-methylidenepyridine
PubChem CID142198451
Molecular FormulaC7H8FN
Molecular Weight125.15 g/mol
Exact Mass125.06
IUPAC Name2-fluoro-1-methyl-6-methylidenepyridine
SMILESC=C1C=CC=C(F)N1C
InChIInChI=1S/C7H8FN/c1-6-4-3-5-7(8)9(6)2/h3-5H,1H2,2H3
InChIKeyJCSLAWRHNPROSM-UHFFFAOYSA-N
XLogP1.81
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.15
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-methyl-6-methylidenepyridine?
The IUPAC name of 2-fluoro-1-methyl-6-methylidenepyridine (CID 142198451) is 2-fluoro-1-methyl-6-methylidenepyridine.
What is the SMILES notation for 2-fluoro-1-methyl-6-methylidenepyridine?
The canonical SMILES for 2-fluoro-1-methyl-6-methylidenepyridine is C=C1C=CC=C(F)N1C.
What is the InChIKey of 2-fluoro-1-methyl-6-methylidenepyridine?
The InChIKey is JCSLAWRHNPROSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FN/c1-6-4-3-5-7(8)9(6)2/h3-5H,1H2,2H3.
What are the key properties of 2-fluoro-1-methyl-6-methylidenepyridine?
2-fluoro-1-methyl-6-methylidenepyridine has a molecular weight of 125.15 g/mol, XLogP of 1.81, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-methyl-6-methylidenepyridine is sourced from PubChem (CID 142198451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).