N-cyclooctyl-2-(2-methylphenoxy)acetamide

C17H25NO2 — CID 814223

IUPACN-cyclooctyl-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)NC1CCCCCCC1
InChIInChI=1S/C17H25NO2/c1-14-9-7-8-12-16(14)20-13-17(19)18-15-10-5-3-2-4-6-11-15/h7-9,12,15H,2-6,10-11,13H2,1H3,(H,18,19)
InChIKeyDWVLFOTVBQJILO-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.60
Rot. Bonds4

About N-cyclooctyl-2-(2-methylphenoxy)acetamide

N-cyclooctyl-2-(2-methylphenoxy)acetamide (PubChem CID 814223) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-cyclooctyl-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-cyclooctyl-2-(2-methylphenoxy)acetamide
PubChem CID814223
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-cyclooctyl-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)NC1CCCCCCC1
InChIInChI=1S/C17H25NO2/c1-14-9-7-8-12-16(14)20-13-17(19)18-15-10-5-3-2-4-6-11-15/h7-9,12,15H,2-6,10-11,13H2,1H3,(H,18,19)
InChIKeyDWVLFOTVBQJILO-UHFFFAOYSA-N
XLogP3.60
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-cyclooctyl-2-(2-methylphenoxy)acetamide (CID 814223) is N-cyclooctyl-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-cyclooctyl-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-cyclooctyl-2-(2-methylphenoxy)acetamide is Cc1ccccc1OCC(=O)NC1CCCCCCC1.
What is the InChIKey of N-cyclooctyl-2-(2-methylphenoxy)acetamide?
The InChIKey is DWVLFOTVBQJILO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-14-9-7-8-12-16(14)20-13-17(19)18-15-10-5-3-2-4-6-11-15/h7-9,12,15H,2-6,10-11,13H2,1H3,(H,18,19).
What are the key properties of N-cyclooctyl-2-(2-methylphenoxy)acetamide?
N-cyclooctyl-2-(2-methylphenoxy)acetamide has a molecular weight of 275.39 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 814223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).