2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide

C16H16FNO2 — CID 9042833

IUPAC2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2ccccc2C)cc1F
InChIInChI=1S/C16H16FNO2/c1-11-5-3-4-6-14(11)18-16(19)10-12-7-8-15(20-2)13(17)9-12/h3-9H,10H2,1-2H3,(H,18,19)
InChIKeyHBFNKRKDDYTJGE-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.32
Rot. Bonds4

About 2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide

2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide (PubChem CID 9042833) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is 2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide
PubChem CID9042833
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC Name2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2ccccc2C)cc1F
InChIInChI=1S/C16H16FNO2/c1-11-5-3-4-6-14(11)18-16(19)10-12-7-8-15(20-2)13(17)9-12/h3-9H,10H2,1-2H3,(H,18,19)
InChIKeyHBFNKRKDDYTJGE-UHFFFAOYSA-N
XLogP3.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide (CID 9042833) is 2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide is COc1ccc(CC(=O)Nc2ccccc2C)cc1F.
What is the InChIKey of 2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide?
The InChIKey is HBFNKRKDDYTJGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2/c1-11-5-3-4-6-14(11)18-16(19)10-12-7-8-15(20-2)13(17)9-12/h3-9H,10H2,1-2H3,(H,18,19).
What are the key properties of 2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide?
2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide has a molecular weight of 273.31 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 9042833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).