N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide

C10H17N3O3 — CID 104619698

IUPACN-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide
SMILESCCc1cc(NC(=O)COCCOC)n[nH]1
InChIInChI=1S/C10H17N3O3/c1-3-8-6-9(13-12-8)11-10(14)7-16-5-4-15-2/h6H,3-5,7H2,1-2H3,(H2,11,12,13,14)
InChIKeyLNOWNKLWKPUGOB-UHFFFAOYSA-N
MW227.26 g/mol
LogP0.57
Rot. Bonds7

About N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide

N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide (PubChem CID 104619698) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide.

Molecular Properties

Compound NameN-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide
PubChem CID104619698
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC NameN-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide
SMILESCCc1cc(NC(=O)COCCOC)n[nH]1
InChIInChI=1S/C10H17N3O3/c1-3-8-6-9(13-12-8)11-10(14)7-16-5-4-15-2/h6H,3-5,7H2,1-2H3,(H2,11,12,13,14)
InChIKeyLNOWNKLWKPUGOB-UHFFFAOYSA-N
XLogP0.57
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 50.57
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-[2-[(5-ethyl-1H-pyrazol-3-yl)amino]-2-oxoethoxy]acetic acid
CID 104617294
(5-ethyl-1H-pyrazol-3-yl)urea
CID 104620406
3-(2,2-difluoroethoxy)-N-(5-ethyl-1H-pyrazol-3-yl)propanamide
CID 103209298
N-(5-ethyl-1H-pyrazol-3-yl)-4-(methoxymethyl)benzamide
CID 47423292
N-(5-ethyl-1H-pyrazol-3-yl)-2-(1H-pyrazol-5-yl)acetamide
CID 115663310
N-(5-ethyl-1H-pyrazol-3-yl)-3-methylsulfanylpropanamide
CID 115593810
N-(5-ethyl-1H-pyrazol-3-yl)cyclopent-3-ene-1-carboxamide
CID 115644958
N-(5-ethyl-1H-pyrazol-3-yl)-3-methylpentanamide
CID 114875544
N-(5-ethyl-1H-pyrazol-3-yl)-2H-triazole-4-carboxamide
CID 47423483
4-amino-N-(5-ethyl-1H-pyrazol-3-yl)pentanamide
CID 104617963
2-tert-butylsulfanyl-N-(5-ethyl-1H-pyrazol-3-yl)acetamide
CID 115593811
N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide
CID 47423285

Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide?
The IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide (CID 104619698) is N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide.
What is the SMILES notation for N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide?
The canonical SMILES for N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide is CCc1cc(NC(=O)COCCOC)n[nH]1.
What is the InChIKey of N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide?
The InChIKey is LNOWNKLWKPUGOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c1-3-8-6-9(13-12-8)11-10(14)7-16-5-4-15-2/h6H,3-5,7H2,1-2H3,(H2,11,12,13,14).
What are the key properties of N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide?
N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide has a molecular weight of 227.26 g/mol, XLogP of 0.57, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide is sourced from PubChem (CID 104619698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).