2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide

C13H9ClF2N2O — CID 103098029

IUPAC2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide
SMILESO=C(Cc1ccccc1Cl)Nc1ccc(F)nc1F
InChIInChI=1S/C13H9ClF2N2O/c14-9-4-2-1-3-8(9)7-12(19)17-10-5-6-11(15)18-13(10)16/h1-6H,7H2,(H,17,19)
InChIKeyFOAMBUSZTPOLEX-UHFFFAOYSA-N
MW282.68 g/mol
LogP3.19
Rot. Bonds3

About 2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide

2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide (PubChem CID 103098029) has the molecular formula C13H9ClF2N2O and a molecular weight of 282.68 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide
PubChem CID103098029
Molecular FormulaC13H9ClF2N2O
Molecular Weight282.68 g/mol
Exact Mass282.04
IUPAC Name2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide
SMILESO=C(Cc1ccccc1Cl)Nc1ccc(F)nc1F
InChIInChI=1S/C13H9ClF2N2O/c14-9-4-2-1-3-8(9)7-12(19)17-10-5-6-11(15)18-13(10)16/h1-6H,7H2,(H,17,19)
InChIKeyFOAMBUSZTPOLEX-UHFFFAOYSA-N
XLogP3.19
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.68
LogP ≤ 53.19
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 2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide (CID 103098029) is 2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide is O=C(Cc1ccccc1Cl)Nc1ccc(F)nc1F.
What is the InChIKey of 2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide?
The InChIKey is FOAMBUSZTPOLEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClF2N2O/c14-9-4-2-1-3-8(9)7-12(19)17-10-5-6-11(15)18-13(10)16/h1-6H,7H2,(H,17,19).
What are the key properties of 2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide?
2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide has a molecular weight of 282.68 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-(2,6-difluoro-3-pyridinyl)acetamide is sourced from PubChem (CID 103098029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).