4-(2-fluoro-3-methylphenyl)-2-methoxypyridine

C13H12FNO — CID 178155180

IUPAC4-(2-fluoro-3-methylphenyl)-2-methoxypyridine
SMILESCOc1cc(-c2cccc(C)c2F)ccn1
InChIInChI=1S/C13H12FNO/c1-9-4-3-5-11(13(9)14)10-6-7-15-12(8-10)16-2/h3-8H,1-2H3
InChIKeyHRMNSNFOEBNHPH-UHFFFAOYSA-N
MW217.24 g/mol
LogP3.20
Rot. Bonds2

About 4-(2-fluoro-3-methylphenyl)-2-methoxypyridine

4-(2-fluoro-3-methylphenyl)-2-methoxypyridine (PubChem CID 178155180) has the molecular formula C13H12FNO and a molecular weight of 217.24 g/mol. Its IUPAC name is 4-(2-fluoro-3-methylphenyl)-2-methoxypyridine.

Molecular Properties

Compound Name4-(2-fluoro-3-methylphenyl)-2-methoxypyridine
PubChem CID178155180
Molecular FormulaC13H12FNO
Molecular Weight217.24 g/mol
Exact Mass217.09
IUPAC Name4-(2-fluoro-3-methylphenyl)-2-methoxypyridine
SMILESCOc1cc(-c2cccc(C)c2F)ccn1
InChIInChI=1S/C13H12FNO/c1-9-4-3-5-11(13(9)14)10-6-7-15-12(8-10)16-2/h3-8H,1-2H3
InChIKeyHRMNSNFOEBNHPH-UHFFFAOYSA-N
XLogP3.20
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.24
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-3-methylphenyl)-2-methoxypyridine?
The IUPAC name of 4-(2-fluoro-3-methylphenyl)-2-methoxypyridine (CID 178155180) is 4-(2-fluoro-3-methylphenyl)-2-methoxypyridine.
What is the SMILES notation for 4-(2-fluoro-3-methylphenyl)-2-methoxypyridine?
The canonical SMILES for 4-(2-fluoro-3-methylphenyl)-2-methoxypyridine is COc1cc(-c2cccc(C)c2F)ccn1.
What is the InChIKey of 4-(2-fluoro-3-methylphenyl)-2-methoxypyridine?
The InChIKey is HRMNSNFOEBNHPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO/c1-9-4-3-5-11(13(9)14)10-6-7-15-12(8-10)16-2/h3-8H,1-2H3.
What are the key properties of 4-(2-fluoro-3-methylphenyl)-2-methoxypyridine?
4-(2-fluoro-3-methylphenyl)-2-methoxypyridine has a molecular weight of 217.24 g/mol, XLogP of 3.20, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-3-methylphenyl)-2-methoxypyridine is sourced from PubChem (CID 178155180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).