2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine

C13H11F2NO — CID 19910946

IUPAC2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine
SMILESCOc1ccc(-c2ccc(C)cn2)c(F)c1F
InChIInChI=1S/C13H11F2NO/c1-8-3-5-10(16-7-8)9-4-6-11(17-2)13(15)12(9)14/h3-7H,1-2H3
InChIKeyUEGINZAXFVNCGT-UHFFFAOYSA-N
MW235.23 g/mol
LogP3.34
Rot. Bonds2

About 2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine

2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine (PubChem CID 19910946) has the molecular formula C13H11F2NO and a molecular weight of 235.23 g/mol. Its IUPAC name is 2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine.

Molecular Properties

Compound Name2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine
PubChem CID19910946
Molecular FormulaC13H11F2NO
Molecular Weight235.23 g/mol
Exact Mass235.08
IUPAC Name2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine
SMILESCOc1ccc(-c2ccc(C)cn2)c(F)c1F
InChIInChI=1S/C13H11F2NO/c1-8-3-5-10(16-7-8)9-4-6-11(17-2)13(15)12(9)14/h3-7H,1-2H3
InChIKeyUEGINZAXFVNCGT-UHFFFAOYSA-N
XLogP3.34
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.23
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine?
The IUPAC name of 2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine (CID 19910946) is 2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine.
What is the SMILES notation for 2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine?
The canonical SMILES for 2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine is COc1ccc(-c2ccc(C)cn2)c(F)c1F.
What is the InChIKey of 2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine?
The InChIKey is UEGINZAXFVNCGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F2NO/c1-8-3-5-10(16-7-8)9-4-6-11(17-2)13(15)12(9)14/h3-7H,1-2H3.
What are the key properties of 2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine?
2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine has a molecular weight of 235.23 g/mol, XLogP of 3.34, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluoro-4-methoxyphenyl)-5-methylpyridine is sourced from PubChem (CID 19910946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).