2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide

C9H15N3O3 — CID 115629929

IUPAC2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
SMILESCOCCOCC(=O)Nc1[nH]ncc1C
InChIInChI=1S/C9H15N3O3/c1-7-5-10-12-9(7)11-8(13)6-15-4-3-14-2/h5H,3-4,6H2,1-2H3,(H2,10,11,12,13)
InChIKeyTYJMPVKLZBAJFQ-UHFFFAOYSA-N
MW213.24 g/mol
LogP0.32
Rot. Bonds6

About 2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide

2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide (PubChem CID 115629929) has the molecular formula C9H15N3O3 and a molecular weight of 213.24 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
PubChem CID115629929
Molecular FormulaC9H15N3O3
Molecular Weight213.24 g/mol
Exact Mass213.11
IUPAC Name2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
SMILESCOCCOCC(=O)Nc1[nH]ncc1C
InChIInChI=1S/C9H15N3O3/c1-7-5-10-12-9(7)11-8(13)6-15-4-3-14-2/h5H,3-4,6H2,1-2H3,(H2,10,11,12,13)
InChIKeyTYJMPVKLZBAJFQ-UHFFFAOYSA-N
XLogP0.32
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 112691162
N-(4-methyl-1H-pyrazol-5-yl)-3-propoxypropanamide
CID 104620175
2-(3-methylazetidin-3-yl)oxy-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 102656577
N-(4-bromo-2,6-dimethylphenyl)-2-(2-methoxyethoxy)acetamide
CID 113224139
3-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)propanamide
CID 115630345
N-(4-methyl-1H-pyrazol-5-yl)-2-piperidin-4-yloxyacetamide
CID 113433668
4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)butanamide
CID 104621856
ethyl N-(4-methyl-1H-pyrazol-5-yl)carbamate
CID 115630334
2-cyclopropyl-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 115629912
4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide
CID 104621851
N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide
CID 104619698
N-(4-iodo-1H-pyrazol-5-yl)-2-pentoxyacetamide
CID 126832712

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
The IUPAC name of 2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide (CID 115629929) is 2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide.
What is the SMILES notation for 2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
The canonical SMILES for 2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide is COCCOCC(=O)Nc1[nH]ncc1C.
What is the InChIKey of 2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
The InChIKey is TYJMPVKLZBAJFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3/c1-7-5-10-12-9(7)11-8(13)6-15-4-3-14-2/h5H,3-4,6H2,1-2H3,(H2,10,11,12,13).
What are the key properties of 2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide has a molecular weight of 213.24 g/mol, XLogP of 0.32, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide is sourced from PubChem (CID 115629929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).