methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate

C9H12N2O3 — CID 126662388

IUPACmethyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate
SMILESCOC(=O)COc1ccn(C2CC2)n1
InChIInChI=1S/C9H12N2O3/c1-13-9(12)6-14-8-4-5-11(10-8)7-2-3-7/h4-5,7H,2-3,6H2,1H3
InChIKeyAGPAVKDVUXNVML-UHFFFAOYSA-N
MW196.21 g/mol
LogP0.77
Rot. Bonds4

About methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate

methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate (PubChem CID 126662388) has the molecular formula C9H12N2O3 and a molecular weight of 196.21 g/mol. Its IUPAC name is methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate.

Molecular Properties

Compound Namemethyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate
PubChem CID126662388
Molecular FormulaC9H12N2O3
Molecular Weight196.21 g/mol
Exact Mass196.08
IUPAC Namemethyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate
SMILESCOC(=O)COc1ccn(C2CC2)n1
InChIInChI=1S/C9H12N2O3/c1-13-9(12)6-14-8-4-5-11(10-8)7-2-3-7/h4-5,7H,2-3,6H2,1H3
InChIKeyAGPAVKDVUXNVML-UHFFFAOYSA-N
XLogP0.77
TPSA53.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze methyl 2-(1-cyclopropylpyrazol-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

4-(3-ethoxypyrazol-1-yl)piperidine
CID 89388808
N-(1-cyclopropylpyrazol-3-yl)propanamide
CID 170387094
methyl 2-(6-oxo-1-phenylpyridazin-3-yl)oxyacetate
CID 806216
2-(1-cyclohexylpyrazol-3-yl)oxy-2-methylpropanoic acid
CID 71387752
methyl 2-pyridin-2-yloxyacetate
CID 45091085
N-[(1-cyclopropylpyrazol-3-yl)methyl]acetamide;ethane
CID 171523553
1-[4-[4-(1-cyclohexylpyrazol-3-yl)oxybutyl]piperazin-1-yl]ethanone;oxalic acid
CID 66608731
dimethyl 2-[(1-cyclopentylpyrazol-3-yl)methyl]propanedioate
CID 103972375
1-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-2-methoxyethanone
CID 107109068
1-cyclopropylpyrazole-3-carboxamide
CID 129189141
methyl 2-[(5-bromo-2-pyridinyl)oxy]acetate
CID 67448774
[2-acetamido-5-(1-cyclopropylpyrazol-3-yl)-4-pyridinyl] carbamate
CID 175384420

Frequently Asked Questions

What is the IUPAC name of methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate?
The IUPAC name of methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate (CID 126662388) is methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate.
What is the SMILES notation for methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate?
The canonical SMILES for methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate is COC(=O)COc1ccn(C2CC2)n1.
What is the InChIKey of methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate?
The InChIKey is AGPAVKDVUXNVML-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O3/c1-13-9(12)6-14-8-4-5-11(10-8)7-2-3-7/h4-5,7H,2-3,6H2,1H3.
What are the key properties of methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate?
methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate has a molecular weight of 196.21 g/mol, XLogP of 0.77, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(1-cyclopropylpyrazol-3-yl)oxyacetate is sourced from PubChem (CID 126662388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).