2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine

C8H11F2N3O — CID 118936856

IUPAC2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine
SMILESCN(C)CCOc1cc(F)nc(F)n1
InChIInChI=1S/C8H11F2N3O/c1-13(2)3-4-14-7-5-6(9)11-8(10)12-7/h5H,3-4H2,1-2H3
InChIKeyVUBZZMPJLPVTTE-UHFFFAOYSA-N
MW203.19 g/mol
LogP0.70
Rot. Bonds4

About 2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine

2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine (PubChem CID 118936856) has the molecular formula C8H11F2N3O and a molecular weight of 203.19 g/mol. Its IUPAC name is 2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine
PubChem CID118936856
Molecular FormulaC8H11F2N3O
Molecular Weight203.19 g/mol
Exact Mass203.09
IUPAC Name2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine
SMILESCN(C)CCOc1cc(F)nc(F)n1
InChIInChI=1S/C8H11F2N3O/c1-13(2)3-4-14-7-5-6(9)11-8(10)12-7/h5H,3-4H2,1-2H3
InChIKeyVUBZZMPJLPVTTE-UHFFFAOYSA-N
XLogP0.70
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.19
LogP ≤ 50.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[6-chloro-2-(trifluoromethyl)pyrimidin-4-yl]oxy-N,N-dimethylethanamine
CID 106766758
6-[2-(dimethylamino)ethoxy]-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774322
2-chloro-6-[2-(dimethylamino)ethoxy]pyridin-4-amine
CID 71302501
4-[2-(dimethylamino)ethoxy]-N,6-dimethylpyrimidin-2-amine
CID 80870972
6-[2-(dimethylamino)ethoxy]-4-N-methylpyrimidine-2,4-diamine
CID 46705525
2-[2-(dimethylamino)ethoxy]quinoline-4-carboxylic acid
CID 61104780
6-[2-(dimethylamino)ethoxy]-N-ethyl-2-propan-2-ylpyrimidin-4-amine
CID 80963169
2-(6-hydrazinyl-2-propylpyrimidin-4-yl)oxy-N,N-dimethylethanamine
CID 80947210
2-fluoro-4-iodo-6-(2-methoxyethoxy)pyridine
CID 177237388
[2-[2-(dimethylamino)ethoxy]-5-fluorophenyl]methanol
CID 107698691
2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine
CID 20553504
2-(3,4-dimethylphenoxy)-N,N-dimethylethanamine
CID 82075858

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine?
The IUPAC name of 2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine (CID 118936856) is 2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine.
What is the SMILES notation for 2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine?
The canonical SMILES for 2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine is CN(C)CCOc1cc(F)nc(F)n1.
What is the InChIKey of 2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine?
The InChIKey is VUBZZMPJLPVTTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F2N3O/c1-13(2)3-4-14-7-5-6(9)11-8(10)12-7/h5H,3-4H2,1-2H3.
What are the key properties of 2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine?
2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine has a molecular weight of 203.19 g/mol, XLogP of 0.70, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluoropyrimidin-4-yl)oxy-N,N-dimethylethanamine is sourced from PubChem (CID 118936856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).