2-(2-methylpyrazol-3-yl)oxyacetic acid

C6H8N2O3 — CID 84650313

IUPAC2-(2-methylpyrazol-3-yl)oxyacetic acid
SMILESCn1nccc1OCC(=O)O
InChIInChI=1S/C6H8N2O3/c1-8-5(2-3-7-8)11-4-6(9)10/h2-3H,4H2,1H3,(H,9,10)
InChIKeyJEYSHMHBJHORPH-UHFFFAOYSA-N
MW156.14 g/mol
LogP-0.12
Rot. Bonds3

About 2-(2-methylpyrazol-3-yl)oxyacetic acid

2-(2-methylpyrazol-3-yl)oxyacetic acid (PubChem CID 84650313) has the molecular formula C6H8N2O3 and a molecular weight of 156.14 g/mol. Its IUPAC name is 2-(2-methylpyrazol-3-yl)oxyacetic acid.

Molecular Properties

Compound Name2-(2-methylpyrazol-3-yl)oxyacetic acid
PubChem CID84650313
Molecular FormulaC6H8N2O3
Molecular Weight156.14 g/mol
Exact Mass156.05
IUPAC Name2-(2-methylpyrazol-3-yl)oxyacetic acid
SMILESCn1nccc1OCC(=O)O
InChIInChI=1S/C6H8N2O3/c1-8-5(2-3-7-8)11-4-6(9)10/h2-3H,4H2,1H3,(H,9,10)
InChIKeyJEYSHMHBJHORPH-UHFFFAOYSA-N
XLogP-0.12
TPSA64.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.14
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-(2-methylpyrazol-3-yl)oxyacetate
CID 146256718
ethane;5-ethoxy-1-methylpyrazole;propane
CID 154649349
5-(carboxymethoxy)-1-methylpyrazole-3-carboxylic acid
CID 11148327
2-[(2-methylpyrazol-3-yl)sulfonylamino]oxyacetic acid
CID 104709642
4-(2-methylpyrazol-3-yl)pentan-2-one
CID 64719612
5-[(4-methoxyphenyl)methoxy]-1-methylpyrazole
CID 141381468
4-(2-methylpyrazol-3-yl)-4-oxobutanoic acid
CID 82407999
2-(1-methylindazol-5-yl)oxyacetic acid
CID 84673968
4-amino-4-methyl-3-(2-methylpyrazol-3-yl)pentanoic acid
CID 114554584
(1S,5R)-N-[2-methyl-1-(2-methylpyrazol-3-yl)oxypropan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide
CID 86294449
(2R)-2-[2-(2-methylpyrazol-3-yl)ethoxy]propanoic acid
CID 102999451
2-(3-methylbenzimidazol-5-yl)oxyacetic acid
CID 84673953

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpyrazol-3-yl)oxyacetic acid?
The IUPAC name of 2-(2-methylpyrazol-3-yl)oxyacetic acid (CID 84650313) is 2-(2-methylpyrazol-3-yl)oxyacetic acid.
What is the SMILES notation for 2-(2-methylpyrazol-3-yl)oxyacetic acid?
The canonical SMILES for 2-(2-methylpyrazol-3-yl)oxyacetic acid is Cn1nccc1OCC(=O)O.
What is the InChIKey of 2-(2-methylpyrazol-3-yl)oxyacetic acid?
The InChIKey is JEYSHMHBJHORPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O3/c1-8-5(2-3-7-8)11-4-6(9)10/h2-3H,4H2,1H3,(H,9,10).
What are the key properties of 2-(2-methylpyrazol-3-yl)oxyacetic acid?
2-(2-methylpyrazol-3-yl)oxyacetic acid has a molecular weight of 156.14 g/mol, XLogP of -0.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpyrazol-3-yl)oxyacetic acid is sourced from PubChem (CID 84650313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).