ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate

C10H13ClN2O4 — CID 1354710

IUPACethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate
SMILESCCOC(=O)COc1nc(C)c(Cl)c(OC)n1
InChIInChI=1S/C10H13ClN2O4/c1-4-16-7(14)5-17-10-12-6(2)8(11)9(13-10)15-3/h4-5H2,1-3H3
InChIKeyJRLXKGASTJPVPC-UHFFFAOYSA-N
MW260.68 g/mol
LogP1.39
Rot. Bonds5

About ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate

ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate (PubChem CID 1354710) has the molecular formula C10H13ClN2O4 and a molecular weight of 260.68 g/mol. Its IUPAC name is ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate.

Molecular Properties

Compound Nameethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate
PubChem CID1354710
Molecular FormulaC10H13ClN2O4
Molecular Weight260.68 g/mol
Exact Mass260.06
IUPAC Nameethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate
SMILESCCOC(=O)COc1nc(C)c(Cl)c(OC)n1
InChIInChI=1S/C10H13ClN2O4/c1-4-16-7(14)5-17-10-12-6(2)8(11)9(13-10)15-3/h4-5H2,1-3H3
InChIKeyJRLXKGASTJPVPC-UHFFFAOYSA-N
XLogP1.39
TPSA70.54 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.68
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 2-[(3,5,6-trichloro-2-pyridinyl)oxy]acetate
CID 3085207
5-chloro-2-(2-ethoxy-2-oxoethoxy)-3-methoxybenzoic acid
CID 113438814
ethyl 2-(2-chloro-5-fluoropyrimidin-4-yl)oxyacetate
CID 134521692
ethyl 2-(3-methylquinoxalin-2-yl)oxyacetate
CID 86157030
ethyl 2-[3,5-bis(2-ethoxy-2-oxoethoxy)phenoxy]acetate
CID 71361550
ethyl 2-(4-iodo-2,6-dimethoxyphenoxy)acetate
CID 22485514
ethyl 2-[4-chloro-6-(N,2,3-trimethylanilino)pyrimidin-2-yl]oxyacetate
CID 13413748
ethyl 2-(2-amino-5-chlorophenoxy)acetate
CID 62305338
ethyl 2-(3-methoxy-5-methylphenoxy)acetate
CID 59177445
ethyl 2-(3-methoxypyrazin-2-yl)acetate
CID 112692734
propyl 2-[(4-amino-3,5-dichloro-6-fluoro-2-pyridinyl)oxy]acetate
CID 167082569
ethyl 3-(5-chloro-2-methoxy-3-pyridinyl)-3-oxopropanoate
CID 170986768

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate?
The IUPAC name of ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate (CID 1354710) is ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate.
What is the SMILES notation for ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate?
The canonical SMILES for ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate is CCOC(=O)COc1nc(C)c(Cl)c(OC)n1.
What is the InChIKey of ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate?
The InChIKey is JRLXKGASTJPVPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O4/c1-4-16-7(14)5-17-10-12-6(2)8(11)9(13-10)15-3/h4-5H2,1-3H3.
What are the key properties of ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate?
ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate has a molecular weight of 260.68 g/mol, XLogP of 1.39, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(5-chloro-4-methoxy-6-methylpyrimidin-2-yl)oxyacetate is sourced from PubChem (CID 1354710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).