2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide

C15H15FN2O3 — CID 18070697

IUPAC2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide
SMILESCOc1ccc(N)cc1OCC(=O)Nc1ccccc1F
InChIInChI=1S/C15H15FN2O3/c1-20-13-7-6-10(17)8-14(13)21-9-15(19)18-12-5-3-2-4-11(12)16/h2-8H,9,17H2,1H3,(H,18,19)
InChIKeyJQKXMUQWYLWQST-UHFFFAOYSA-N
MW290.29 g/mol
LogP2.43
Rot. Bonds5

About 2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide

2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide (PubChem CID 18070697) has the molecular formula C15H15FN2O3 and a molecular weight of 290.29 g/mol. Its IUPAC name is 2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide
PubChem CID18070697
Molecular FormulaC15H15FN2O3
Molecular Weight290.29 g/mol
Exact Mass290.11
IUPAC Name2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide
SMILESCOc1ccc(N)cc1OCC(=O)Nc1ccccc1F
InChIInChI=1S/C15H15FN2O3/c1-20-13-7-6-10(17)8-14(13)21-9-15(19)18-12-5-3-2-4-11(12)16/h2-8H,9,17H2,1H3,(H,18,19)
InChIKeyJQKXMUQWYLWQST-UHFFFAOYSA-N
XLogP2.43
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide (CID 18070697) is 2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide is COc1ccc(N)cc1OCC(=O)Nc1ccccc1F.
What is the InChIKey of 2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide?
The InChIKey is JQKXMUQWYLWQST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O3/c1-20-13-7-6-10(17)8-14(13)21-9-15(19)18-12-5-3-2-4-11(12)16/h2-8H,9,17H2,1H3,(H,18,19).
What are the key properties of 2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide?
2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide has a molecular weight of 290.29 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 18070697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).