2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide

C16H18N2O2 — CID 957282

IUPAC2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide
SMILESCCc1ccc(OCC(=O)NCc2ccncc2)cc1
InChIInChI=1S/C16H18N2O2/c1-2-13-3-5-15(6-4-13)20-12-16(19)18-11-14-7-9-17-10-8-14/h3-10H,2,11-12H2,1H3,(H,18,19)
InChIKeyHXXRKBPARANZPK-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.34
Rot. Bonds6

About 2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide

2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide (PubChem CID 957282) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide
PubChem CID957282
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide
SMILESCCc1ccc(OCC(=O)NCc2ccncc2)cc1
InChIInChI=1S/C16H18N2O2/c1-2-13-3-5-15(6-4-13)20-12-16(19)18-11-14-7-9-17-10-8-14/h3-10H,2,11-12H2,1H3,(H,18,19)
InChIKeyHXXRKBPARANZPK-UHFFFAOYSA-N
XLogP2.34
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-aminophenoxy)-N-[(4-ethylphenyl)methyl]acetamide
CID 106899089
2-(3-ethoxyphenoxy)-N-(pyridin-4-ylmethyl)acetamide
CID 112977719
2-(4-carbamothioylphenoxy)-N-(pyridin-4-ylmethyl)acetamide
CID 29283325
2-(4-ethylphenoxy)-N-[(1S)-1-pyridin-4-ylethyl]acetamide
CID 28721742
N-[[4-(diethylsulfamoyl)phenyl]methyl]-2-(4-ethylphenoxy)acetamide
CID 26423148
2-(4-ethylphenoxy)-N-[(3-methoxyphenyl)methyl]acetamide
CID 9495684
2-(4-methylphenoxy)-N-[(2-pyridin-4-yl-4-pyridinyl)methyl]acetamide
CID 121165464
2-[4-(2-methylpropylsulfamoyl)phenoxy]-N-(pyridin-4-ylmethyl)acetamide
CID 11837026
2-[(4-ethylphenyl)methylsulfonylamino]-N-(pyridin-4-ylmethyl)acetamide
CID 22299265
2-(4-ethylphenoxy)-N-(pyridin-4-ylmethylideneamino)acetamide
CID 2695082
2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide
CID 1120997
2-[4-(trifluoromethyl)phenoxy]-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
CID 55772582

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide (CID 957282) is 2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide is CCc1ccc(OCC(=O)NCc2ccncc2)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide?
The InChIKey is HXXRKBPARANZPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-2-13-3-5-15(6-4-13)20-12-16(19)18-11-14-7-9-17-10-8-14/h3-10H,2,11-12H2,1H3,(H,18,19).
What are the key properties of 2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide?
2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide has a molecular weight of 270.33 g/mol, XLogP of 2.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide is sourced from PubChem (CID 957282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).