2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide

C11H19N3O3 — CID 103606715

IUPAC2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
SMILESCOCCOCC(=O)Nc1c(C)nn(C)c1C
InChIInChI=1S/C11H19N3O3/c1-8-11(9(2)14(3)13-8)12-10(15)7-17-6-5-16-4/h5-7H2,1-4H3,(H,12,15)
InChIKeyPFOAQWKQTYHQLM-UHFFFAOYSA-N
MW241.29 g/mol
LogP0.64
Rot. Bonds6

About 2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide

2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide (PubChem CID 103606715) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
PubChem CID103606715
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
SMILESCOCCOCC(=O)Nc1c(C)nn(C)c1C
InChIInChI=1S/C11H19N3O3/c1-8-11(9(2)14(3)13-8)12-10(15)7-17-6-5-16-4/h5-7H2,1-4H3,(H,12,15)
InChIKeyPFOAQWKQTYHQLM-UHFFFAOYSA-N
XLogP0.64
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 60717287
N-(4-amino-1,3-dimethylpyrazol-5-yl)-2-(2-methoxyethoxy)acetamide
CID 114031928
2-methylsulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 47006977
2-(2,3,4,5,6-pentachlorophenoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 78811961
N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-propoxyacetamide
CID 48678933
2-(2-methoxy-4-methylphenoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 9354234
2-[bis(2-hydroxyethyl)amino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 60686676
[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-(4-methoxyphenyl)acetate
CID 7699065
methyl 1,5-dimethyl-4-(propanoylamino)pyrazole-3-carboxylate
CID 95748425
2-(prop-2-ynylamino)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 78912800
4-hydroxy-N-(1,3,5-trimethylpyrazol-4-yl)pentanamide
CID 79192900
[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-phenylacetate
CID 7697898

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide?
The IUPAC name of 2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide (CID 103606715) is 2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide.
What is the SMILES notation for 2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide?
The canonical SMILES for 2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide is COCCOCC(=O)Nc1c(C)nn(C)c1C.
What is the InChIKey of 2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide?
The InChIKey is PFOAQWKQTYHQLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-8-11(9(2)14(3)13-8)12-10(15)7-17-6-5-16-4/h5-7H2,1-4H3,(H,12,15).
What are the key properties of 2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide?
2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide has a molecular weight of 241.29 g/mol, XLogP of 0.64, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide is sourced from PubChem (CID 103606715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).