2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide

C16H23NO3 — CID 62366654

IUPAC2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide
SMILESCCc1cccc(OCC(=O)NC2CCCCC2O)c1
InChIInChI=1S/C16H23NO3/c1-2-12-6-5-7-13(10-12)20-11-16(19)17-14-8-3-4-9-15(14)18/h5-7,10,14-15,18H,2-4,8-9,11H2,1H3,(H,17,19)
InChIKeyARFBQOIXAMOFII-UHFFFAOYSA-N
MW277.36 g/mol
LogP2.05
Rot. Bonds5

About 2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide

2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide (PubChem CID 62366654) has the molecular formula C16H23NO3 and a molecular weight of 277.36 g/mol. Its IUPAC name is 2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide.

Molecular Properties

Compound Name2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide
PubChem CID62366654
Molecular FormulaC16H23NO3
Molecular Weight277.36 g/mol
Exact Mass277.17
IUPAC Name2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide
SMILESCCc1cccc(OCC(=O)NC2CCCCC2O)c1
InChIInChI=1S/C16H23NO3/c1-2-12-6-5-7-13(10-12)20-11-16(19)17-14-8-3-4-9-15(14)18/h5-7,10,14-15,18H,2-4,8-9,11H2,1H3,(H,17,19)
InChIKeyARFBQOIXAMOFII-UHFFFAOYSA-N
XLogP2.05
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide?
The IUPAC name of 2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide (CID 62366654) is 2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide.
What is the SMILES notation for 2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide?
The canonical SMILES for 2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide is CCc1cccc(OCC(=O)NC2CCCCC2O)c1.
What is the InChIKey of 2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide?
The InChIKey is ARFBQOIXAMOFII-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO3/c1-2-12-6-5-7-13(10-12)20-11-16(19)17-14-8-3-4-9-15(14)18/h5-7,10,14-15,18H,2-4,8-9,11H2,1H3,(H,17,19).
What are the key properties of 2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide?
2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide has a molecular weight of 277.36 g/mol, XLogP of 2.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylphenoxy)-N-(2-hydroxycyclohexyl)acetamide is sourced from PubChem (CID 62366654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).