4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine

C14H14FNO — CID 103434468

IUPAC4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine
SMILESCOc1c(-c2cc(F)ccn2)ccc(C)c1C
InChIInChI=1S/C14H14FNO/c1-9-4-5-12(14(17-3)10(9)2)13-8-11(15)6-7-16-13/h4-8H,1-3H3
InChIKeyNJICGQDIQORAAE-UHFFFAOYSA-N
MW231.27 g/mol
LogP3.51
Rot. Bonds2

About 4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine

4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine (PubChem CID 103434468) has the molecular formula C14H14FNO and a molecular weight of 231.27 g/mol. Its IUPAC name is 4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine.

Molecular Properties

Compound Name4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine
PubChem CID103434468
Molecular FormulaC14H14FNO
Molecular Weight231.27 g/mol
Exact Mass231.11
IUPAC Name4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine
SMILESCOc1c(-c2cc(F)ccn2)ccc(C)c1C
InChIInChI=1S/C14H14FNO/c1-9-4-5-12(14(17-3)10(9)2)13-8-11(15)6-7-16-13/h4-8H,1-3H3
InChIKeyNJICGQDIQORAAE-UHFFFAOYSA-N
XLogP3.51
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine?
The IUPAC name of 4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine (CID 103434468) is 4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine.
What is the SMILES notation for 4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine?
The canonical SMILES for 4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine is COc1c(-c2cc(F)ccn2)ccc(C)c1C.
What is the InChIKey of 4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine?
The InChIKey is NJICGQDIQORAAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO/c1-9-4-5-12(14(17-3)10(9)2)13-8-11(15)6-7-16-13/h4-8H,1-3H3.
What are the key properties of 4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine?
4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine has a molecular weight of 231.27 g/mol, XLogP of 3.51, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-(2-methoxy-3,4-dimethylphenyl)pyridine is sourced from PubChem (CID 103434468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).