ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate

C10H14N2O3 — CID 3410252

IUPACethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate
SMILESCCOC(=O)COc1nc(C)cc(C)n1
InChIInChI=1S/C10H14N2O3/c1-4-14-9(13)6-15-10-11-7(2)5-8(3)12-10/h5H,4,6H2,1-3H3
InChIKeyZTTSWTYNJNLSDI-UHFFFAOYSA-N
MW210.23 g/mol
LogP1.04
Rot. Bonds4

About ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate

ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate (PubChem CID 3410252) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate.

Molecular Properties

Compound Nameethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate
PubChem CID3410252
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Nameethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate
SMILESCCOC(=O)COc1nc(C)cc(C)n1
InChIInChI=1S/C10H14N2O3/c1-4-14-9(13)6-15-10-11-7(2)5-8(3)12-10/h5H,4,6H2,1-3H3
InChIKeyZTTSWTYNJNLSDI-UHFFFAOYSA-N
XLogP1.04
TPSA61.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate?
The IUPAC name of ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate (CID 3410252) is ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate.
What is the SMILES notation for ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate?
The canonical SMILES for ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate is CCOC(=O)COc1nc(C)cc(C)n1.
What is the InChIKey of ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate?
The InChIKey is ZTTSWTYNJNLSDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-4-14-9(13)6-15-10-11-7(2)5-8(3)12-10/h5H,4,6H2,1-3H3.
What are the key properties of ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate?
ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate has a molecular weight of 210.23 g/mol, XLogP of 1.04, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(4,6-dimethylpyrimidin-2-yl)oxyacetate is sourced from PubChem (CID 3410252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).