2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide

C15H19N3O2 — CID 115680804

IUPAC2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide
SMILESCCc1ccc(OCC(=O)Nc2[nH]ncc2CC)cc1
InChIInChI=1S/C15H19N3O2/c1-3-11-5-7-13(8-6-11)20-10-14(19)17-15-12(4-2)9-16-18-15/h5-9H,3-4,10H2,1-2H3,(H2,16,17,18,19)
InChIKeyFPMLPYNZWIBIQZ-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.55
Rot. Bonds6

About 2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide

2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide (PubChem CID 115680804) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide
PubChem CID115680804
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide
SMILESCCc1ccc(OCC(=O)Nc2[nH]ncc2CC)cc1
InChIInChI=1S/C15H19N3O2/c1-3-11-5-7-13(8-6-11)20-10-14(19)17-15-12(4-2)9-16-18-15/h5-9H,3-4,10H2,1-2H3,(H2,16,17,18,19)
InChIKeyFPMLPYNZWIBIQZ-UHFFFAOYSA-N
XLogP2.55
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide (CID 115680804) is 2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide is CCc1ccc(OCC(=O)Nc2[nH]ncc2CC)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide?
The InChIKey is FPMLPYNZWIBIQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-3-11-5-7-13(8-6-11)20-10-14(19)17-15-12(4-2)9-16-18-15/h5-9H,3-4,10H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide?
2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide has a molecular weight of 273.34 g/mol, XLogP of 2.55, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide is sourced from PubChem (CID 115680804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).