6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine

C13H20F2N2O — CID 114072964

IUPAC6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine
SMILESCCCCC(CC)COc1nc(N)c(F)cc1F
InChIInChI=1S/C13H20F2N2O/c1-3-5-6-9(4-2)8-18-13-11(15)7-10(14)12(16)17-13/h7,9H,3-6,8H2,1-2H3,(H2,16,17)
InChIKeyFBCWRVDIQVGFRG-UHFFFAOYSA-N
MW258.31 g/mol
LogP3.54
Rot. Bonds7

About 6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine

6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine (PubChem CID 114072964) has the molecular formula C13H20F2N2O and a molecular weight of 258.31 g/mol. Its IUPAC name is 6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine.

Molecular Properties

Compound Name6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine
PubChem CID114072964
Molecular FormulaC13H20F2N2O
Molecular Weight258.31 g/mol
Exact Mass258.15
IUPAC Name6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine
SMILESCCCCC(CC)COc1nc(N)c(F)cc1F
InChIInChI=1S/C13H20F2N2O/c1-3-5-6-9(4-2)8-18-13-11(15)7-10(14)12(16)17-13/h7,9H,3-6,8H2,1-2H3,(H2,16,17)
InChIKeyFBCWRVDIQVGFRG-UHFFFAOYSA-N
XLogP3.54
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.31
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(2-ethylhexoxy)-2,5-dimethylpyrimidin-4-amine
CID 80861981
6-(2-ethylhexoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80989394
2-(2-ethylhexoxy)-5-fluoro-4-propoxyaniline
CID 63594054
6-ethyl-4-(2-ethylhexoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331283
5-amino-6-(2-ethylhexoxy)pyridine-2-carboxylic acid
CID 114408651
4-(2-ethylhexoxy)-2-fluoro-1-methylbenzene
CID 107171247
5-(chloromethyl)-2-(2-ethylhexoxy)-1,3-difluorobenzene
CID 79887959
6-(2-ethylhexoxy)-2-propan-2-ylpyrimidin-4-amine
CID 80966278
2-(2-ethylhexoxy)-6-(trifluoromethyl)pyridine-3-carbonitrile
CID 79876034
1-[4-(2-ethylhexoxy)-3-fluorophenyl]ethanamine
CID 43128566
6-(2-ethylhexoxy)-2-propoxypyridin-3-amine
CID 43262515
3-(chloromethyl)-2-(2-ethylhexoxy)-4,6-dimethylpyridine
CID 55200147

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine?
The IUPAC name of 6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine (CID 114072964) is 6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine.
What is the SMILES notation for 6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine?
The canonical SMILES for 6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine is CCCCC(CC)COc1nc(N)c(F)cc1F.
What is the InChIKey of 6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine?
The InChIKey is FBCWRVDIQVGFRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20F2N2O/c1-3-5-6-9(4-2)8-18-13-11(15)7-10(14)12(16)17-13/h7,9H,3-6,8H2,1-2H3,(H2,16,17).
What are the key properties of 6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine?
6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine has a molecular weight of 258.31 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethylhexoxy)-3,5-difluoropyridin-2-amine is sourced from PubChem (CID 114072964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).