2-(1,1-difluoroethoxymethyl)pyridine

C8H9F2NO — CID 68641957

IUPAC2-(1,1-difluoroethoxymethyl)pyridine
SMILESCC(F)(F)OCc1ccccn1
InChIInChI=1S/C8H9F2NO/c1-8(9,10)12-6-7-4-2-3-5-11-7/h2-5H,6H2,1H3
InChIKeyNILKQTYRQVNSKI-UHFFFAOYSA-N
MW173.16 g/mol
LogP2.21
Rot. Bonds3

About 2-(1,1-difluoroethoxymethyl)pyridine

2-(1,1-difluoroethoxymethyl)pyridine (PubChem CID 68641957) has the molecular formula C8H9F2NO and a molecular weight of 173.16 g/mol. Its IUPAC name is 2-(1,1-difluoroethoxymethyl)pyridine.

Molecular Properties

Compound Name2-(1,1-difluoroethoxymethyl)pyridine
PubChem CID68641957
Molecular FormulaC8H9F2NO
Molecular Weight173.16 g/mol
Exact Mass173.07
IUPAC Name2-(1,1-difluoroethoxymethyl)pyridine
SMILESCC(F)(F)OCc1ccccn1
InChIInChI=1S/C8H9F2NO/c1-8(9,10)12-6-7-4-2-3-5-11-7/h2-5H,6H2,1H3
InChIKeyNILKQTYRQVNSKI-UHFFFAOYSA-N
XLogP2.21
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.16
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(hydroxymethyl)-2-(pyridin-2-ylmethoxy)propane-1,3-diol
CID 150698152
pyridin-2-ylmethyl hypoiodite
CID 67567753
N-(pyridin-2-ylmethoxy)methanamine
CID 58351102
2-(5,5-dimethylhexyl)pyridine
CID 151657269
2,2-dimethyl-N-(pyridin-2-ylmethoxy)propanamide
CID 86795436
2-bromo-2-[4-(pyridin-2-ylmethoxy)phenyl]propanoic acid
CID 91416861
pyridin-2-ylmethyl 3,3-dimethyl-2-methylidenebutanoate
CID 11458652
2-(pyridin-4-yloxymethyl)pyridine
CID 58505689
pyridin-2-ylmethyl 2,2-dimethylpentanoate
CID 3053080
2-[(2-bromo-4-tert-butylphenoxy)methyl]pyridine
CID 170931613
ethane;2-ethylpyridine
CID 91102000
ethane;pyridin-2-ylmethanamine
CID 90791011

Frequently Asked Questions

What is the IUPAC name of 2-(1,1-difluoroethoxymethyl)pyridine?
The IUPAC name of 2-(1,1-difluoroethoxymethyl)pyridine (CID 68641957) is 2-(1,1-difluoroethoxymethyl)pyridine.
What is the SMILES notation for 2-(1,1-difluoroethoxymethyl)pyridine?
The canonical SMILES for 2-(1,1-difluoroethoxymethyl)pyridine is CC(F)(F)OCc1ccccn1.
What is the InChIKey of 2-(1,1-difluoroethoxymethyl)pyridine?
The InChIKey is NILKQTYRQVNSKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F2NO/c1-8(9,10)12-6-7-4-2-3-5-11-7/h2-5H,6H2,1H3.
What are the key properties of 2-(1,1-difluoroethoxymethyl)pyridine?
2-(1,1-difluoroethoxymethyl)pyridine has a molecular weight of 173.16 g/mol, XLogP of 2.21, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-difluoroethoxymethyl)pyridine is sourced from PubChem (CID 68641957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).