N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide

C15H13FN2O3 — CID 78929098

IUPACN-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide
SMILESCc1ccc(OCC(=O)Nc2ccccc2F)c(C=O)n1
InChIInChI=1S/C15H13FN2O3/c1-10-6-7-14(13(8-19)17-10)21-9-15(20)18-12-5-3-2-4-11(12)16/h2-8H,9H2,1H3,(H,18,20)
InChIKeyAARSOFWJPAZQKL-UHFFFAOYSA-N
MW288.28 g/mol
LogP2.36
Rot. Bonds5

About N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide

N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide (PubChem CID 78929098) has the molecular formula C15H13FN2O3 and a molecular weight of 288.28 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide
PubChem CID78929098
Molecular FormulaC15H13FN2O3
Molecular Weight288.28 g/mol
Exact Mass288.09
IUPAC NameN-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide
SMILESCc1ccc(OCC(=O)Nc2ccccc2F)c(C=O)n1
InChIInChI=1S/C15H13FN2O3/c1-10-6-7-14(13(8-19)17-10)21-9-15(20)18-12-5-3-2-4-11(12)16/h2-8H,9H2,1H3,(H,18,20)
InChIKeyAARSOFWJPAZQKL-UHFFFAOYSA-N
XLogP2.36
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.28
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-chlorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide
CID 78929086
N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide
CID 78929091
2-(2,3-dimethylphenoxy)-N-(2-fluorophenyl)acetamide
CID 720662
N-(2-fluorophenyl)-2-(2-formyl-6-methylphenoxy)acetamide
CID 115955575
2-(2-fluoro-6-formylphenoxy)-N-(2-fluorophenyl)acetamide
CID 115955813
2-(2-chloro-5-methylphenoxy)-N-(2-fluorophenyl)acetamide
CID 7642832
2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide
CID 79157217
2-[2-(2-fluoroanilino)-2-oxoethoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 26362871
2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide
CID 65102015
2-(4-bromo-2,3,5-trimethylphenoxy)-N-(2-fluorophenyl)acetamide
CID 4650894
2-(2-bromo-4-chlorophenoxy)-N-(2-fluorophenyl)acetamide
CID 2627508
N-(2-fluoro-4-methylphenyl)-2-(2-fluorophenoxy)acetamide
CID 7815061

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide?
The IUPAC name of N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide (CID 78929098) is N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide?
The canonical SMILES for N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide is Cc1ccc(OCC(=O)Nc2ccccc2F)c(C=O)n1.
What is the InChIKey of N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide?
The InChIKey is AARSOFWJPAZQKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O3/c1-10-6-7-14(13(8-19)17-10)21-9-15(20)18-12-5-3-2-4-11(12)16/h2-8H,9H2,1H3,(H,18,20).
What are the key properties of N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide?
N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide has a molecular weight of 288.28 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide is sourced from PubChem (CID 78929098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).