2-(4-chlorophenoxy)-N-cyclooctylacetamide

C16H22ClNO2 — CID 875180

IUPAC2-(4-chlorophenoxy)-N-cyclooctylacetamide
SMILESO=C(COc1ccc(Cl)cc1)NC1CCCCCCC1
InChIInChI=1S/C16H22ClNO2/c17-13-8-10-15(11-9-13)20-12-16(19)18-14-6-4-2-1-3-5-7-14/h8-11,14H,1-7,12H2,(H,18,19)
InChIKeyUNQWYOUYKCIMRQ-UHFFFAOYSA-N
MW295.81 g/mol
LogP3.95
Rot. Bonds4

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

2-(4-chlorophenoxy)-N-cyclooctylacetamide (PubChem CID 875180) has the molecular formula C16H22ClNO2 and a molecular weight of 295.81 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-cyclooctylacetamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-cyclooctylacetamide
PubChem CID875180
Molecular FormulaC16H22ClNO2
Molecular Weight295.81 g/mol
Exact Mass295.13
IUPAC Name2-(4-chlorophenoxy)-N-cyclooctylacetamide
SMILESO=C(COc1ccc(Cl)cc1)NC1CCCCCCC1
InChIInChI=1S/C16H22ClNO2/c17-13-8-10-15(11-9-13)20-12-16(19)18-14-6-4-2-1-3-5-7-14/h8-11,14H,1-7,12H2,(H,18,19)
InChIKeyUNQWYOUYKCIMRQ-UHFFFAOYSA-N
XLogP3.95
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.81
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenoxy)-N-[3-[[2-(4-chlorophenoxy)acetyl]amino]cyclopentyl]acetamide
CID 177253885
N-[4-[[2-(4-chlorophenoxy)acetyl]amino]cyclohexyl]-2-(4-methoxyphenoxy)acetamide
CID 121260490
2-[4-[(4-chlorophenyl)sulfamoyl]phenoxy]-N-cyclohexylacetamide
CID 3886490
N-cyclohexyl-2-(4-iodophenoxy)acetamide
CID 1313853
N-cyclododecyl-2-(4-methylphenoxy)acetamide
CID 2788426
N-[4-[[2-(4-chlorophenoxy)acetyl]amino]cyclohexyl]-2-(4-ethynylphenoxy)acetamide
CID 90446748
N-cyclohexyl-2-(3,4-difluorophenoxy)acetamide
CID 78767908
2-(4-chlorophenoxy)-N-[4-[[2-(3,5-difluorophenoxy)acetyl]amino]cyclohexyl]acetamide
CID 121260487
4-[[2-(4-chlorophenoxy)acetyl]amino]piperidine-1-carboxylic acid
CID 68885629
3-(4-chlorophenoxy)-N-cyclopentylpropanamide
CID 108790008
2-(4-acetylphenoxy)-N-cyclohexylacetamide
CID 2621514
N-cycloheptyl-2-[4-(methylamino)phenoxy]acetamide
CID 61027576

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-cyclooctylacetamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-cyclooctylacetamide (CID 875180) is 2-(4-chlorophenoxy)-N-cyclooctylacetamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-cyclooctylacetamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-cyclooctylacetamide is O=C(COc1ccc(Cl)cc1)NC1CCCCCCC1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-cyclooctylacetamide?
The InChIKey is UNQWYOUYKCIMRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22ClNO2/c17-13-8-10-15(11-9-13)20-12-16(19)18-14-6-4-2-1-3-5-7-14/h8-11,14H,1-7,12H2,(H,18,19).
What are the key properties of 2-(4-chlorophenoxy)-N-cyclooctylacetamide?
2-(4-chlorophenoxy)-N-cyclooctylacetamide has a molecular weight of 295.81 g/mol, XLogP of 3.95, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-cyclooctylacetamide is sourced from PubChem (CID 875180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).