ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate

C10H15N3O3 — CID 59336099

IUPACethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate
SMILESCCOC(=O)COc1c(C)nc(N)nc1C
InChIInChI=1S/C10H15N3O3/c1-4-15-8(14)5-16-9-6(2)12-10(11)13-7(9)3/h4-5H2,1-3H3,(H2,11,12,13)
InChIKeyGOAZRSGRZKCNOZ-UHFFFAOYSA-N
MW225.25 g/mol
LogP0.62
Rot. Bonds4

About ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate

ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate (PubChem CID 59336099) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate.

Molecular Properties

Compound Nameethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate
PubChem CID59336099
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC Nameethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate
SMILESCCOC(=O)COc1c(C)nc(N)nc1C
InChIInChI=1S/C10H15N3O3/c1-4-15-8(14)5-16-9-6(2)12-10(11)13-7(9)3/h4-5H2,1-3H3,(H2,11,12,13)
InChIKeyGOAZRSGRZKCNOZ-UHFFFAOYSA-N
XLogP0.62
TPSA87.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate?
The IUPAC name of ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate (CID 59336099) is ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate.
What is the SMILES notation for ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate?
The canonical SMILES for ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate is CCOC(=O)COc1c(C)nc(N)nc1C.
What is the InChIKey of ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate?
The InChIKey is GOAZRSGRZKCNOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-4-15-8(14)5-16-9-6(2)12-10(11)13-7(9)3/h4-5H2,1-3H3,(H2,11,12,13).
What are the key properties of ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate?
ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate has a molecular weight of 225.25 g/mol, XLogP of 0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-amino-4,6-dimethylpyrimidin-5-yl)oxyacetate is sourced from PubChem (CID 59336099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).