2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide

C11H12FNO2 — CID 82126666

IUPAC2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide
SMILESC=CCNC(=O)C(O)c1ccc(F)cc1
InChIInChI=1S/C11H12FNO2/c1-2-7-13-11(15)10(14)8-3-5-9(12)6-4-8/h2-6,10,14H,1,7H2,(H,13,15)
InChIKeyKNZCKQLQZDTEIZ-UHFFFAOYSA-N
MW209.22 g/mol
LogP1.16
Rot. Bonds4

About 2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide

2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide (PubChem CID 82126666) has the molecular formula C11H12FNO2 and a molecular weight of 209.22 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide
PubChem CID82126666
Molecular FormulaC11H12FNO2
Molecular Weight209.22 g/mol
Exact Mass209.09
IUPAC Name2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide
SMILESC=CCNC(=O)C(O)c1ccc(F)cc1
InChIInChI=1S/C11H12FNO2/c1-2-7-13-11(15)10(14)8-3-5-9(12)6-4-8/h2-6,10,14H,1,7H2,(H,13,15)
InChIKeyKNZCKQLQZDTEIZ-UHFFFAOYSA-N
XLogP1.16
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[1-(4-fluorophenyl)ethylsulfanyl]-N-prop-2-enylpropanamide
CID 75402794
4-fluoro-N-[(2S)-3-methyl-1-oxo-1-(prop-2-enylamino)butan-2-yl]benzamide
CID 8008521
2-[4-[bis(prop-2-enyl)amino]phenyl]-1-(4-fluorophenyl)-2-hydroxyethanone
CID 89146696
2-hydroxy-N,N'-bis(prop-2-enyl)propanediamide
CID 59934483
(2R)-2-(4-fluoro-N-methylsulfonylanilino)-N-prop-2-enylpropanamide
CID 124561228
N-cyclopropyl-2-(4-fluorophenyl)-2-hydroxyacetamide
CID 82126665
(E)-3-(4-fluorophenyl)-N-prop-2-enylprop-2-enamide
CID 6143200
2-(4-fluorophenyl)-2-hydroxy-N-(4-methylphenyl)acetamide
CID 82132590
1-[(E)-2-(4-fluorophenyl)ethenyl]-3-prop-2-enylurea
CID 108908110
[1-oxo-1-(prop-2-enylamino)propan-2-yl] 2-bromo-4-fluorobenzoate
CID 18092138
2-(2-chloro-5-fluoroanilino)-N-prop-2-enylpropanamide
CID 107528240
(2R)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-prop-2-enylpropanamide
CID 9493174

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide?
The IUPAC name of 2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide (CID 82126666) is 2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide.
What is the SMILES notation for 2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide?
The canonical SMILES for 2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide is C=CCNC(=O)C(O)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide?
The InChIKey is KNZCKQLQZDTEIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO2/c1-2-7-13-11(15)10(14)8-3-5-9(12)6-4-8/h2-6,10,14H,1,7H2,(H,13,15).
What are the key properties of 2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide?
2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide has a molecular weight of 209.22 g/mol, XLogP of 1.16, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-2-hydroxy-N-prop-2-enylacetamide is sourced from PubChem (CID 82126666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).