N-(2-fluoro-6-formyl-4-methylphenyl)acetamide

C10H10FNO2 — CID 84773346

IUPACN-(2-fluoro-6-formyl-4-methylphenyl)acetamide
SMILESCC(=O)Nc1c(F)cc(C)cc1C=O
InChIInChI=1S/C10H10FNO2/c1-6-3-8(5-13)10(9(11)4-6)12-7(2)14/h3-5H,1-2H3,(H,12,14)
InChIKeyXBSNMKOEMJHSFN-UHFFFAOYSA-N
MW195.19 g/mol
LogP1.91
Rot. Bonds2

About N-(2-fluoro-6-formyl-4-methylphenyl)acetamide

N-(2-fluoro-6-formyl-4-methylphenyl)acetamide (PubChem CID 84773346) has the molecular formula C10H10FNO2 and a molecular weight of 195.19 g/mol. Its IUPAC name is N-(2-fluoro-6-formyl-4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-fluoro-6-formyl-4-methylphenyl)acetamide
PubChem CID84773346
Molecular FormulaC10H10FNO2
Molecular Weight195.19 g/mol
Exact Mass195.07
IUPAC NameN-(2-fluoro-6-formyl-4-methylphenyl)acetamide
SMILESCC(=O)Nc1c(F)cc(C)cc1C=O
InChIInChI=1S/C10H10FNO2/c1-6-3-8(5-13)10(9(11)4-6)12-7(2)14/h3-5H,1-2H3,(H,12,14)
InChIKeyXBSNMKOEMJHSFN-UHFFFAOYSA-N
XLogP1.91
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.19
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-6-formyl-4-methylphenyl)acetamide?
The IUPAC name of N-(2-fluoro-6-formyl-4-methylphenyl)acetamide (CID 84773346) is N-(2-fluoro-6-formyl-4-methylphenyl)acetamide.
What is the SMILES notation for N-(2-fluoro-6-formyl-4-methylphenyl)acetamide?
The canonical SMILES for N-(2-fluoro-6-formyl-4-methylphenyl)acetamide is CC(=O)Nc1c(F)cc(C)cc1C=O.
What is the InChIKey of N-(2-fluoro-6-formyl-4-methylphenyl)acetamide?
The InChIKey is XBSNMKOEMJHSFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO2/c1-6-3-8(5-13)10(9(11)4-6)12-7(2)14/h3-5H,1-2H3,(H,12,14).
What are the key properties of N-(2-fluoro-6-formyl-4-methylphenyl)acetamide?
N-(2-fluoro-6-formyl-4-methylphenyl)acetamide has a molecular weight of 195.19 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-6-formyl-4-methylphenyl)acetamide is sourced from PubChem (CID 84773346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).