2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile

C14H9F3N2O — CID 114766779

IUPAC2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile
SMILESCc1cc(C#N)cc(Oc2ccccc2C(F)(F)F)n1
InChIInChI=1S/C14H9F3N2O/c1-9-6-10(8-18)7-13(19-9)20-12-5-3-2-4-11(12)14(15,16)17/h2-7H,1H3
InChIKeyPOOCHUIWCNVBNC-UHFFFAOYSA-N
MW278.23 g/mol
LogP4.07
Rot. Bonds2

About 2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile

2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile (PubChem CID 114766779) has the molecular formula C14H9F3N2O and a molecular weight of 278.23 g/mol. Its IUPAC name is 2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile.

Molecular Properties

Compound Name2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile
PubChem CID114766779
Molecular FormulaC14H9F3N2O
Molecular Weight278.23 g/mol
Exact Mass278.07
IUPAC Name2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile
SMILESCc1cc(C#N)cc(Oc2ccccc2C(F)(F)F)n1
InChIInChI=1S/C14H9F3N2O/c1-9-6-10(8-18)7-13(19-9)20-12-5-3-2-4-11(12)14(15,16)17/h2-7H,1H3
InChIKeyPOOCHUIWCNVBNC-UHFFFAOYSA-N
XLogP4.07
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.23
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-6-naphthalen-1-yloxypyridine-4-carbonitrile
CID 114766811
2-(2-ethoxyphenoxy)-6-methylpyridine-4-carbonitrile
CID 114766792
4-methyl-6-[2-(trifluoromethyl)phenoxy]pyrimidin-2-amine
CID 80862420
2-(3-chloro-2-fluorophenoxy)-6-methylpyridine-4-carbonitrile
CID 114766993
2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbothioamide
CID 114768084
2-(4-amino-2-fluorophenoxy)-6-methylpyridine-4-carbonitrile
CID 114769789
2-(2-amino-5-methylphenoxy)-6-methylpyridine-4-carbonitrile
CID 114769786
5-methyl-2-[2-(trifluoromethyl)phenoxy]benzonitrile
CID 107928062
3-[(4-cyano-6-methyl-2-pyridinyl)oxy]benzoic acid
CID 114770378
2-(2-bromo-5-nitrophenoxy)-6-methylpyridine-4-carbonitrile
CID 103010100
2-[2-(trifluoromethyl)phenoxy]pyridine-3-carbonitrile
CID 24708942
6-[4-cyano-2-(trifluoromethyl)phenoxy]pyridine-2-carbonitrile
CID 115467723

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile?
The IUPAC name of 2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile (CID 114766779) is 2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile.
What is the SMILES notation for 2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile?
The canonical SMILES for 2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile is Cc1cc(C#N)cc(Oc2ccccc2C(F)(F)F)n1.
What is the InChIKey of 2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile?
The InChIKey is POOCHUIWCNVBNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F3N2O/c1-9-6-10(8-18)7-13(19-9)20-12-5-3-2-4-11(12)14(15,16)17/h2-7H,1H3.
What are the key properties of 2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile?
2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile has a molecular weight of 278.23 g/mol, XLogP of 4.07, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[2-(trifluoromethyl)phenoxy]pyridine-4-carbonitrile is sourced from PubChem (CID 114766779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).