2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide

C15H22N2O2 — CID 136531808

IUPAC2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide
SMILESCCC1CCCCC1OCC(=O)Nc1ccncc1
InChIInChI=1S/C15H22N2O2/c1-2-12-5-3-4-6-14(12)19-11-15(18)17-13-7-9-16-10-8-13/h7-10,12,14H,2-6,11H2,1H3,(H,16,17,18)
InChIKeyDLOZHMYRNNKTAG-UHFFFAOYSA-N
MW262.35 g/mol
LogP3.01
Rot. Bonds5

About 2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide

2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide (PubChem CID 136531808) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide.

Molecular Properties

Compound Name2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide
PubChem CID136531808
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide
SMILESCCC1CCCCC1OCC(=O)Nc1ccncc1
InChIInChI=1S/C15H22N2O2/c1-2-12-5-3-4-6-14(12)19-11-15(18)17-13-7-9-16-10-8-13/h7-10,12,14H,2-6,11H2,1H3,(H,16,17,18)
InChIKeyDLOZHMYRNNKTAG-UHFFFAOYSA-N
XLogP3.01
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide?
The IUPAC name of 2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide (CID 136531808) is 2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide.
What is the SMILES notation for 2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide?
The canonical SMILES for 2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide is CCC1CCCCC1OCC(=O)Nc1ccncc1.
What is the InChIKey of 2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide?
The InChIKey is DLOZHMYRNNKTAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-2-12-5-3-4-6-14(12)19-11-15(18)17-13-7-9-16-10-8-13/h7-10,12,14H,2-6,11H2,1H3,(H,16,17,18).
What are the key properties of 2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide?
2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide has a molecular weight of 262.35 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylcyclohexyl)oxy-N-pyridin-4-ylacetamide is sourced from PubChem (CID 136531808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).