2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide

C19H21N3O4 — CID 122266032

IUPAC2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide
SMILESCCOc1ccc(OCC(=O)NCC(c2ccco2)n2cccn2)cc1
InChIInChI=1S/C19H21N3O4/c1-2-24-15-6-8-16(9-7-15)26-14-19(23)20-13-17(18-5-3-12-25-18)22-11-4-10-21-22/h3-12,17H,2,13-14H2,1H3,(H,20,23)
InChIKeyXAQNUTTZCRJWQL-UHFFFAOYSA-N
MW355.39 g/mol
LogP2.66
Rot. Bonds9

About 2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide

2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide (PubChem CID 122266032) has the molecular formula C19H21N3O4 and a molecular weight of 355.39 g/mol. Its IUPAC name is 2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide.

Molecular Properties

Compound Name2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide
PubChem CID122266032
Molecular FormulaC19H21N3O4
Molecular Weight355.39 g/mol
Exact Mass355.15
IUPAC Name2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide
SMILESCCOc1ccc(OCC(=O)NCC(c2ccco2)n2cccn2)cc1
InChIInChI=1S/C19H21N3O4/c1-2-24-15-6-8-16(9-7-15)26-14-19(23)20-13-17(18-5-3-12-25-18)22-11-4-10-21-22/h3-12,17H,2,13-14H2,1H3,(H,20,23)
InChIKeyXAQNUTTZCRJWQL-UHFFFAOYSA-N
XLogP2.66
TPSA78.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-ethoxy-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide
CID 122265940
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-3-methylbutanamide
CID 122265939
1-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-3-[2-(4-methoxyphenyl)ethyl]urea
CID 122266305
2-cyclohexyl-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide
CID 122265953
N-(furan-2-ylmethyl)-N'-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]oxamide
CID 122266212
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-2,2-diphenylacetamide
CID 122266052
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclopentanecarboxamide
CID 122265941
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-N'-(4-methylphenyl)oxamide
CID 122266215
1-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]-3-(2-methoxyphenyl)urea
CID 122266298
N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]cyclohexanecarboxamide
CID 122265946
N-[2-(azepan-1-yl)-2-(furan-2-yl)ethyl]-2-(4-chlorophenoxy)acetamide
CID 112503361
N-[2,2-bis(furan-2-yl)ethyl]-2-(4-ethoxyphenyl)acetamide
CID 131702564

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide?
The IUPAC name of 2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide (CID 122266032) is 2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide.
What is the SMILES notation for 2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide?
The canonical SMILES for 2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide is CCOc1ccc(OCC(=O)NCC(c2ccco2)n2cccn2)cc1.
What is the InChIKey of 2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide?
The InChIKey is XAQNUTTZCRJWQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4/c1-2-24-15-6-8-16(9-7-15)26-14-19(23)20-13-17(18-5-3-12-25-18)22-11-4-10-21-22/h3-12,17H,2,13-14H2,1H3,(H,20,23).
What are the key properties of 2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide?
2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide has a molecular weight of 355.39 g/mol, XLogP of 2.66, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenoxy)-N-[2-(furan-2-yl)-2-pyrazol-1-ylethyl]acetamide is sourced from PubChem (CID 122266032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).