2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide

C15H16N2O2 — CID 26592501

IUPAC2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide
SMILESCCc1cccc(OCC(=O)Nc2cccnc2)c1
InChIInChI=1S/C15H16N2O2/c1-2-12-5-3-7-14(9-12)19-11-15(18)17-13-6-4-8-16-10-13/h3-10H,2,11H2,1H3,(H,17,18)
InChIKeyWPNIKHCUHDQBMG-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.66
Rot. Bonds5

About 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide

2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide (PubChem CID 26592501) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide
PubChem CID26592501
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide
SMILESCCc1cccc(OCC(=O)Nc2cccnc2)c1
InChIInChI=1S/C15H16N2O2/c1-2-12-5-3-7-14(9-12)19-11-15(18)17-13-6-4-8-16-10-13/h3-10H,2,11H2,1H3,(H,17,18)
InChIKeyWPNIKHCUHDQBMG-UHFFFAOYSA-N
XLogP2.66
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide?
The IUPAC name of 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide (CID 26592501) is 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide is CCc1cccc(OCC(=O)Nc2cccnc2)c1.
What is the InChIKey of 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide?
The InChIKey is WPNIKHCUHDQBMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-2-12-5-3-7-14(9-12)19-11-15(18)17-13-6-4-8-16-10-13/h3-10H,2,11H2,1H3,(H,17,18).
What are the key properties of 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide?
2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide has a molecular weight of 256.31 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide is sourced from PubChem (CID 26592501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).