2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide

C17H18N2O3 — CID 24607642

IUPAC2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide
SMILESCC(=O)c1ccc(OCC(=O)NCCc2ccccn2)cc1
InChIInChI=1S/C17H18N2O3/c1-13(20)14-5-7-16(8-6-14)22-12-17(21)19-11-9-15-4-2-3-10-18-15/h2-8,10H,9,11-12H2,1H3,(H,19,21)
InChIKeyFMRORFZXJMVEEO-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.02
Rot. Bonds7

About 2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide

2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide (PubChem CID 24607642) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is 2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide
PubChem CID24607642
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC Name2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide
SMILESCC(=O)c1ccc(OCC(=O)NCCc2ccccn2)cc1
InChIInChI=1S/C17H18N2O3/c1-13(20)14-5-7-16(8-6-14)22-12-17(21)19-11-9-15-4-2-3-10-18-15/h2-8,10H,9,11-12H2,1H3,(H,19,21)
InChIKeyFMRORFZXJMVEEO-UHFFFAOYSA-N
XLogP2.02
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide
CID 4784838
2-(2,6-dimethylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide
CID 29292137
2-(3-acetylphenoxy)-N-(pyridin-2-ylmethyl)acetamide
CID 40628702
N-[2-oxo-2-(2-pyridin-2-ylethylamino)ethyl]-4-phenoxybenzamide
CID 2549071
2-phenoxy-N-(pyridin-2-ylmethyl)acetamide
CID 853197
4-(4-tert-butylphenoxy)-N-(2-pyridin-2-ylethyl)butanamide
CID 78784602
2-(4-propoxyphenoxy)-N-(pyridin-2-ylmethyl)acetamide
CID 35750358
4-(4-fluorophenoxy)-N-(2-pyridin-2-ylethyl)butanamide
CID 86920418
2-(4-acetylphenoxy)-N-(3-phenylsulfanylpropyl)acetamide
CID 26352192
2-(4-acetyl-2-fluorophenyl)sulfanyl-N-(2-pyridin-2-ylethyl)acetamide
CID 51164073
2-(6-oxobenzo[c]chromen-3-yl)oxy-N-(2-pyridin-2-ylethyl)acetamide
CID 156790060
4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-N-(2-pyridin-2-ylethyl)benzamide
CID 15434237

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide?
The IUPAC name of 2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide (CID 24607642) is 2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide.
What is the SMILES notation for 2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide?
The canonical SMILES for 2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide is CC(=O)c1ccc(OCC(=O)NCCc2ccccn2)cc1.
What is the InChIKey of 2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide?
The InChIKey is FMRORFZXJMVEEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-13(20)14-5-7-16(8-6-14)22-12-17(21)19-11-9-15-4-2-3-10-18-15/h2-8,10H,9,11-12H2,1H3,(H,19,21).
What are the key properties of 2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide?
2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide has a molecular weight of 298.34 g/mol, XLogP of 2.02, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide is sourced from PubChem (CID 24607642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).