2-(4-fluorophenyl)-4-hydroxybutanamide

C10H12FNO2 — CID 22013235

IUPAC2-(4-fluorophenyl)-4-hydroxybutanamide
SMILESNC(=O)C(CCO)c1ccc(F)cc1
InChIInChI=1S/C10H12FNO2/c11-8-3-1-7(2-4-8)9(5-6-13)10(12)14/h1-4,9,13H,5-6H2,(H2,12,14)
InChIKeyPQTSYBHOWSLFHL-UHFFFAOYSA-N
MW197.21 g/mol
LogP0.78
Rot. Bonds4

About 2-(4-fluorophenyl)-4-hydroxybutanamide

2-(4-fluorophenyl)-4-hydroxybutanamide (PubChem CID 22013235) has the molecular formula C10H12FNO2 and a molecular weight of 197.21 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-4-hydroxybutanamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-4-hydroxybutanamide
PubChem CID22013235
Molecular FormulaC10H12FNO2
Molecular Weight197.21 g/mol
Exact Mass197.09
IUPAC Name2-(4-fluorophenyl)-4-hydroxybutanamide
SMILESNC(=O)C(CCO)c1ccc(F)cc1
InChIInChI=1S/C10H12FNO2/c11-8-3-1-7(2-4-8)9(5-6-13)10(12)14/h1-4,9,13H,5-6H2,(H2,12,14)
InChIKeyPQTSYBHOWSLFHL-UHFFFAOYSA-N
XLogP0.78
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.21
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-4-hydroxybutanamide?
The IUPAC name of 2-(4-fluorophenyl)-4-hydroxybutanamide (CID 22013235) is 2-(4-fluorophenyl)-4-hydroxybutanamide.
What is the SMILES notation for 2-(4-fluorophenyl)-4-hydroxybutanamide?
The canonical SMILES for 2-(4-fluorophenyl)-4-hydroxybutanamide is NC(=O)C(CCO)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-4-hydroxybutanamide?
The InChIKey is PQTSYBHOWSLFHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO2/c11-8-3-1-7(2-4-8)9(5-6-13)10(12)14/h1-4,9,13H,5-6H2,(H2,12,14).
What are the key properties of 2-(4-fluorophenyl)-4-hydroxybutanamide?
2-(4-fluorophenyl)-4-hydroxybutanamide has a molecular weight of 197.21 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-4-hydroxybutanamide is sourced from PubChem (CID 22013235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).