N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide

C13H11F2N3O — CID 113021840

IUPACN-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide
SMILESCC(=O)Nc1ccc(Nc2ccc(F)cc2F)nc1
InChIInChI=1S/C13H11F2N3O/c1-8(19)17-10-3-5-13(16-7-10)18-12-4-2-9(14)6-11(12)15/h2-7H,1H3,(H,16,18)(H,17,19)
InChIKeyGBOOQHCIMAYNQY-UHFFFAOYSA-N
MW263.25 g/mol
LogP3.06
Rot. Bonds3

About N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide

N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide (PubChem CID 113021840) has the molecular formula C13H11F2N3O and a molecular weight of 263.25 g/mol. Its IUPAC name is N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide
PubChem CID113021840
Molecular FormulaC13H11F2N3O
Molecular Weight263.25 g/mol
Exact Mass263.09
IUPAC NameN-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide
SMILESCC(=O)Nc1ccc(Nc2ccc(F)cc2F)nc1
InChIInChI=1S/C13H11F2N3O/c1-8(19)17-10-3-5-13(16-7-10)18-12-4-2-9(14)6-11(12)15/h2-7H,1H3,(H,16,18)(H,17,19)
InChIKeyGBOOQHCIMAYNQY-UHFFFAOYSA-N
XLogP3.06
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.25
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-(2,4-difluoroanilino)-3-pyridinyl]-3-propan-2-ylurea
CID 113021903
N-[6-(2,4-difluoroanilino)-3-pyridinyl]-3-fluorobenzamide
CID 113021858
6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide
CID 109164503
2-(4-chlorophenoxy)-N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide
CID 113021877
N-[5-(2,4-difluoroanilino)-2-pyridinyl]-2-ethylbutanamide
CID 113036420
N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide
CID 113020010
N-[6-(2,5-difluoroanilino)-3-pyridinyl]-2,6-difluorobenzamide
CID 67126920
5-(2,4-difluoroanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109198992
N-[6-(2,4-difluoroanilino)-3-pyridinyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 113021926
N-[6-(4-acetamidoanilino)-3-pyridinyl]-2-fluorobenzamide
CID 113020547
6-(2,4-difluoroanilino)-N-(4-fluorophenyl)pyridazine-3-carboxamide
CID 109128560
N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109162562

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide?
The IUPAC name of N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide (CID 113021840) is N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide.
What is the SMILES notation for N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide?
The canonical SMILES for N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide is CC(=O)Nc1ccc(Nc2ccc(F)cc2F)nc1.
What is the InChIKey of N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide?
The InChIKey is GBOOQHCIMAYNQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F2N3O/c1-8(19)17-10-3-5-13(16-7-10)18-12-4-2-9(14)6-11(12)15/h2-7H,1H3,(H,16,18)(H,17,19).
What are the key properties of N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide?
N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide has a molecular weight of 263.25 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide is sourced from PubChem (CID 113021840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).