2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide

C17H19NO3 — CID 836085

IUPAC2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide
SMILESCOc1ccc(OCC(=O)N[C@H](C)c2ccccc2)cc1
InChIInChI=1S/C17H19NO3/c1-13(14-6-4-3-5-7-14)18-17(19)12-21-16-10-8-15(20-2)9-11-16/h3-11,13H,12H2,1-2H3,(H,18,19)/t13-/m1/s1
InChIKeyFFOBQYXFINAABF-CYBMUJFWSA-N
MW285.34 g/mol
LogP2.95
Rot. Bonds6

About 2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide

2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide (PubChem CID 836085) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide
PubChem CID836085
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide
SMILESCOc1ccc(OCC(=O)N[C@H](C)c2ccccc2)cc1
InChIInChI=1S/C17H19NO3/c1-13(14-6-4-3-5-7-14)18-17(19)12-21-16-10-8-15(20-2)9-11-16/h3-11,13H,12H2,1-2H3,(H,18,19)/t13-/m1/s1
InChIKeyFFOBQYXFINAABF-CYBMUJFWSA-N
XLogP2.95
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide?
The IUPAC name of 2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide (CID 836085) is 2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide.
What is the SMILES notation for 2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide?
The canonical SMILES for 2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide is COc1ccc(OCC(=O)N[C@H](C)c2ccccc2)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide?
The InChIKey is FFOBQYXFINAABF-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H19NO3/c1-13(14-6-4-3-5-7-14)18-17(19)12-21-16-10-8-15(20-2)9-11-16/h3-11,13H,12H2,1-2H3,(H,18,19)/t13-/m1/s1.
What are the key properties of 2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide?
2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide has a molecular weight of 285.34 g/mol, XLogP of 2.95, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide is sourced from PubChem (CID 836085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).