ethyl 2-(2-methylpyrazol-3-yl)oxyacetate

C8H12N2O3 — CID 146256718

IUPACethyl 2-(2-methylpyrazol-3-yl)oxyacetate
SMILESCCOC(=O)COc1ccnn1C
InChIInChI=1S/C8H12N2O3/c1-3-12-8(11)6-13-7-4-5-9-10(7)2/h4-5H,3,6H2,1-2H3
InChIKeyISBHMNIMDXAETA-UHFFFAOYSA-N
MW184.19 g/mol
LogP0.36
Rot. Bonds4

About ethyl 2-(2-methylpyrazol-3-yl)oxyacetate

ethyl 2-(2-methylpyrazol-3-yl)oxyacetate (PubChem CID 146256718) has the molecular formula C8H12N2O3 and a molecular weight of 184.19 g/mol. Its IUPAC name is ethyl 2-(2-methylpyrazol-3-yl)oxyacetate.

Molecular Properties

Compound Nameethyl 2-(2-methylpyrazol-3-yl)oxyacetate
PubChem CID146256718
Molecular FormulaC8H12N2O3
Molecular Weight184.19 g/mol
Exact Mass184.08
IUPAC Nameethyl 2-(2-methylpyrazol-3-yl)oxyacetate
SMILESCCOC(=O)COc1ccnn1C
InChIInChI=1S/C8H12N2O3/c1-3-12-8(11)6-13-7-4-5-9-10(7)2/h4-5H,3,6H2,1-2H3
InChIKeyISBHMNIMDXAETA-UHFFFAOYSA-N
XLogP0.36
TPSA53.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.19
LogP ≤ 50.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze ethyl 2-(2-methylpyrazol-3-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

2-(2-methylpyrazol-3-yl)oxyacetic acid
CID 84650313
ethane;5-ethoxy-1-methylpyrazole;propane
CID 154649349
methyl 5-(2-ethoxy-2-oxoethoxy)-1-methylpyrazole-3-carboxylate
CID 11333961
ethyl 2-[3,5-bis(2-ethoxy-2-oxoethoxy)phenoxy]acetate
CID 71361550
ethyl 2-(1-methyl-5-pyrimidin-2-ylpyrazol-3-yl)oxyacetate
CID 174197140
ethyl 3-[(2-methylpyrazol-3-yl)carbamoylamino]propanoate
CID 108813860
ethyl (E)-3-(2-methylpyrazol-3-yl)prop-2-enoate
CID 77230263
ethyl 2-[(3-bromo-4-methyl-2-pyridinyl)oxy]acetate
CID 164553275
ethyl 2,3-dihydroxy-3-(2-methylpyrazol-3-yl)propanoate
CID 171867144
ethane;ethyl 2-(2,3,4-trimethoxyphenoxy)acetate
CID 144536056
ethyl 4-[(2-methylpyrazol-3-yl)sulfonylamino]butanoate
CID 113444020
ethyl 2-[[5-(3-chloro-4-pyridinyl)-1-methyl-1,2,4-triazol-3-yl]oxy]acetate
CID 170442342

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-methylpyrazol-3-yl)oxyacetate?
The IUPAC name of ethyl 2-(2-methylpyrazol-3-yl)oxyacetate (CID 146256718) is ethyl 2-(2-methylpyrazol-3-yl)oxyacetate.
What is the SMILES notation for ethyl 2-(2-methylpyrazol-3-yl)oxyacetate?
The canonical SMILES for ethyl 2-(2-methylpyrazol-3-yl)oxyacetate is CCOC(=O)COc1ccnn1C.
What is the InChIKey of ethyl 2-(2-methylpyrazol-3-yl)oxyacetate?
The InChIKey is ISBHMNIMDXAETA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3/c1-3-12-8(11)6-13-7-4-5-9-10(7)2/h4-5H,3,6H2,1-2H3.
What are the key properties of ethyl 2-(2-methylpyrazol-3-yl)oxyacetate?
ethyl 2-(2-methylpyrazol-3-yl)oxyacetate has a molecular weight of 184.19 g/mol, XLogP of 0.36, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-methylpyrazol-3-yl)oxyacetate is sourced from PubChem (CID 146256718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).