2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide

C16H17FN2O3 — CID 77080089

IUPAC2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide
SMILESO=C(NCCCn1ccccc1=O)C(O)c1ccc(F)cc1
InChIInChI=1S/C16H17FN2O3/c17-13-7-5-12(6-8-13)15(21)16(22)18-9-3-11-19-10-2-1-4-14(19)20/h1-2,4-8,10,15,21H,3,9,11H2,(H,18,22)
InChIKeyMFIAPUUPHLMCKD-UHFFFAOYSA-N
MW304.32 g/mol
LogP1.23
Rot. Bonds6

About 2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide

2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide (PubChem CID 77080089) has the molecular formula C16H17FN2O3 and a molecular weight of 304.32 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide
PubChem CID77080089
Molecular FormulaC16H17FN2O3
Molecular Weight304.32 g/mol
Exact Mass304.12
IUPAC Name2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide
SMILESO=C(NCCCn1ccccc1=O)C(O)c1ccc(F)cc1
InChIInChI=1S/C16H17FN2O3/c17-13-7-5-12(6-8-13)15(21)16(22)18-9-3-11-19-10-2-1-4-14(19)20/h1-2,4-8,10,15,21H,3,9,11H2,(H,18,22)
InChIKeyMFIAPUUPHLMCKD-UHFFFAOYSA-N
XLogP1.23
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.32
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(3-hydroxybutyl)-3-[4-(2-oxo-1-pyridinyl)butyl]urea
CID 111338596
3-(4-fluorophenyl)-N-[4-(2-oxo-1-pyridinyl)butyl]prop-2-enamide
CID 103598831
1-[2-(4-fluorophenoxy)propyl]-2-methyl-3-[4-(2-oxo-1-pyridinyl)butyl]guanidine
CID 111678590
1-[2-(4-fluorophenoxy)propyl]-2-methyl-3-[4-(2-oxo-1-pyridinyl)butyl]guanidine;hydroiodide
CID 111678589
(2S)-2-(4-fluorophenyl)-3-hydroxy-N-(3-indol-1-ylpropyl)propanamide
CID 124727193
1-ethyl-2-[2-(4-fluorophenoxy)propyl]-3-[4-(2-oxo-1-pyridinyl)butyl]guanidine
CID 111677850
1-ethyl-2-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-3-[4-(2-oxo-1-pyridinyl)butyl]guanidine
CID 111312414
1,2-dimethyl-3-[4-(2-oxo-1-pyridinyl)butyl]guanidine
CID 75526639
(2R)-2-cyclopentyloxy-N-[3-(2-oxo-1-pyridinyl)propyl]butanamide
CID 96533467
2-methyl-1-[4-(2-oxo-1-pyridinyl)butyl]-3-propan-2-ylguanidine;hydroiodide
CID 111126471
1-[3-(2-methylpropylamino)propyl]pyridin-2-one
CID 62564337
N-(5-fluoro-2-methylphenyl)-3-(2-oxo-1-pyridinyl)propanamide
CID 86979424

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide?
The IUPAC name of 2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide (CID 77080089) is 2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide.
What is the SMILES notation for 2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide?
The canonical SMILES for 2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide is O=C(NCCCn1ccccc1=O)C(O)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide?
The InChIKey is MFIAPUUPHLMCKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O3/c17-13-7-5-12(6-8-13)15(21)16(22)18-9-3-11-19-10-2-1-4-14(19)20/h1-2,4-8,10,15,21H,3,9,11H2,(H,18,22).
What are the key properties of 2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide?
2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide has a molecular weight of 304.32 g/mol, XLogP of 1.23, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-2-hydroxy-N-[3-(2-oxo-1-pyridinyl)propyl]acetamide is sourced from PubChem (CID 77080089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).