4-chloro-3-fluoro-2-methylpyridine

C6H5ClFN — CID 18727750

IUPAC4-chloro-3-fluoro-2-methylpyridine
SMILESCc1nccc(Cl)c1F
InChIInChI=1S/C6H5ClFN/c1-4-6(8)5(7)2-3-9-4/h2-3H,1H3
InChIKeyQKONHJYDMVSGAL-UHFFFAOYSA-N
MW145.56 g/mol
LogP2.18
Rot. Bonds

About 4-chloro-3-fluoro-2-methylpyridine

4-chloro-3-fluoro-2-methylpyridine (PubChem CID 18727750) has the molecular formula C6H5ClFN and a molecular weight of 145.56 g/mol. Its IUPAC name is 4-chloro-3-fluoro-2-methylpyridine.

Molecular Properties

Compound Name4-chloro-3-fluoro-2-methylpyridine
PubChem CID18727750
Molecular FormulaC6H5ClFN
Molecular Weight145.56 g/mol
Exact Mass145.01
IUPAC Name4-chloro-3-fluoro-2-methylpyridine
SMILESCc1nccc(Cl)c1F
InChIInChI=1S/C6H5ClFN/c1-4-6(8)5(7)2-3-9-4/h2-3H,1H3
InChIKeyQKONHJYDMVSGAL-UHFFFAOYSA-N
XLogP2.18
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.56
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-fluoro-2-methylpyridine?
The IUPAC name of 4-chloro-3-fluoro-2-methylpyridine (CID 18727750) is 4-chloro-3-fluoro-2-methylpyridine.
What is the SMILES notation for 4-chloro-3-fluoro-2-methylpyridine?
The canonical SMILES for 4-chloro-3-fluoro-2-methylpyridine is Cc1nccc(Cl)c1F.
What is the InChIKey of 4-chloro-3-fluoro-2-methylpyridine?
The InChIKey is QKONHJYDMVSGAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5ClFN/c1-4-6(8)5(7)2-3-9-4/h2-3H,1H3.
What are the key properties of 4-chloro-3-fluoro-2-methylpyridine?
4-chloro-3-fluoro-2-methylpyridine has a molecular weight of 145.56 g/mol, XLogP of 2.18, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-fluoro-2-methylpyridine is sourced from PubChem (CID 18727750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).