N-(6-fluoro-4-methyl-2-pyridinyl)acetamide

C8H9FN2O — CID 170575880

IUPACN-(6-fluoro-4-methyl-2-pyridinyl)acetamide
SMILESCC(=O)Nc1cc(C)cc(F)n1
InChIInChI=1S/C8H9FN2O/c1-5-3-7(9)11-8(4-5)10-6(2)12/h3-4H,1-2H3,(H,10,11,12)
InChIKeyHZJGMRNKGRUMJZ-UHFFFAOYSA-N
MW168.17 g/mol
LogP1.49
Rot. Bonds1

About N-(6-fluoro-4-methyl-2-pyridinyl)acetamide

N-(6-fluoro-4-methyl-2-pyridinyl)acetamide (PubChem CID 170575880) has the molecular formula C8H9FN2O and a molecular weight of 168.17 g/mol. Its IUPAC name is N-(6-fluoro-4-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(6-fluoro-4-methyl-2-pyridinyl)acetamide
PubChem CID170575880
Molecular FormulaC8H9FN2O
Molecular Weight168.17 g/mol
Exact Mass168.07
IUPAC NameN-(6-fluoro-4-methyl-2-pyridinyl)acetamide
SMILESCC(=O)Nc1cc(C)cc(F)n1
InChIInChI=1S/C8H9FN2O/c1-5-3-7(9)11-8(4-5)10-6(2)12/h3-4H,1-2H3,(H,10,11,12)
InChIKeyHZJGMRNKGRUMJZ-UHFFFAOYSA-N
XLogP1.49
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.17
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-4-methyl-2-pyridinyl)acetamide?
The IUPAC name of N-(6-fluoro-4-methyl-2-pyridinyl)acetamide (CID 170575880) is N-(6-fluoro-4-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for N-(6-fluoro-4-methyl-2-pyridinyl)acetamide?
The canonical SMILES for N-(6-fluoro-4-methyl-2-pyridinyl)acetamide is CC(=O)Nc1cc(C)cc(F)n1.
What is the InChIKey of N-(6-fluoro-4-methyl-2-pyridinyl)acetamide?
The InChIKey is HZJGMRNKGRUMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FN2O/c1-5-3-7(9)11-8(4-5)10-6(2)12/h3-4H,1-2H3,(H,10,11,12).
What are the key properties of N-(6-fluoro-4-methyl-2-pyridinyl)acetamide?
N-(6-fluoro-4-methyl-2-pyridinyl)acetamide has a molecular weight of 168.17 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-4-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 170575880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).