2-(4-acetamidophenoxy)-N-cyclooctylacetamide

C18H26N2O3 — CID 112774945

IUPAC2-(4-acetamidophenoxy)-N-cyclooctylacetamide
SMILESCC(=O)Nc1ccc(OCC(=O)NC2CCCCCCC2)cc1
InChIInChI=1S/C18H26N2O3/c1-14(21)19-16-9-11-17(12-10-16)23-13-18(22)20-15-7-5-3-2-4-6-8-15/h9-12,15H,2-8,13H2,1H3,(H,19,21)(H,20,22)
InChIKeyCOERLZFOUZNGHC-UHFFFAOYSA-N
MW318.42 g/mol
LogP3.25
Rot. Bonds5

About 2-(4-acetamidophenoxy)-N-cyclooctylacetamide

2-(4-acetamidophenoxy)-N-cyclooctylacetamide (PubChem CID 112774945) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is 2-(4-acetamidophenoxy)-N-cyclooctylacetamide.

Molecular Properties

Compound Name2-(4-acetamidophenoxy)-N-cyclooctylacetamide
PubChem CID112774945
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC Name2-(4-acetamidophenoxy)-N-cyclooctylacetamide
SMILESCC(=O)Nc1ccc(OCC(=O)NC2CCCCCCC2)cc1
InChIInChI=1S/C18H26N2O3/c1-14(21)19-16-9-11-17(12-10-16)23-13-18(22)20-15-7-5-3-2-4-6-8-15/h9-12,15H,2-8,13H2,1H3,(H,19,21)(H,20,22)
InChIKeyCOERLZFOUZNGHC-UHFFFAOYSA-N
XLogP3.25
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-2-[4-(methylamino)phenoxy]acetamide
CID 61027576
2-(4-acetylphenoxy)-N-cyclohexylacetamide
CID 2621514
N-cyclododecyl-2-(4-methylphenoxy)acetamide
CID 2788426
N-cyclohexyl-2-[4-(4-methylphenyl)phenoxy]acetamide
CID 720119
N-cyclohexyl-2-(4-iodophenoxy)acetamide
CID 1313853
2-(4-chlorophenoxy)-N-cyclooctylacetamide
CID 875180
2-(4-acetamidophenoxy)-N-(4-acetamidophenyl)acetamide
CID 7203623
2-(4-acetamidophenoxy)-N-[[(1R,2S)-2-methylcyclohexyl]carbamoyl]acetamide
CID 7203614
2-[4-(1-aminoethyl)phenoxy]-N-cyclopentylacetamide
CID 43186036
N-cycloheptyl-2-(4-propanoylphenoxy)acetamide
CID 2549658
N-cyclohexyl-4-[[2-(4-methoxyphenoxy)acetyl]amino]benzamide
CID 28587702
N-cyclopentyl-2-[4-(hydroxymethyl)phenoxy]acetamide
CID 28561633

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidophenoxy)-N-cyclooctylacetamide?
The IUPAC name of 2-(4-acetamidophenoxy)-N-cyclooctylacetamide (CID 112774945) is 2-(4-acetamidophenoxy)-N-cyclooctylacetamide.
What is the SMILES notation for 2-(4-acetamidophenoxy)-N-cyclooctylacetamide?
The canonical SMILES for 2-(4-acetamidophenoxy)-N-cyclooctylacetamide is CC(=O)Nc1ccc(OCC(=O)NC2CCCCCCC2)cc1.
What is the InChIKey of 2-(4-acetamidophenoxy)-N-cyclooctylacetamide?
The InChIKey is COERLZFOUZNGHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-14(21)19-16-9-11-17(12-10-16)23-13-18(22)20-15-7-5-3-2-4-6-8-15/h9-12,15H,2-8,13H2,1H3,(H,19,21)(H,20,22).
What are the key properties of 2-(4-acetamidophenoxy)-N-cyclooctylacetamide?
2-(4-acetamidophenoxy)-N-cyclooctylacetamide has a molecular weight of 318.42 g/mol, XLogP of 3.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidophenoxy)-N-cyclooctylacetamide is sourced from PubChem (CID 112774945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).