4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide

C10H10F3NO2 — CID 10944340

IUPAC4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide
SMILESNC(=O)C(O)(CC(F)(F)F)c1ccccc1
InChIInChI=1S/C10H10F3NO2/c11-10(12,13)6-9(16,8(14)15)7-4-2-1-3-5-7/h1-5,16H,6H2,(H2,14,15)
InChIKeyFZPZLJQPHYSRPK-UHFFFAOYSA-N
MW233.19 g/mol
LogP1.31
Rot. Bonds3

About 4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide

4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide (PubChem CID 10944340) has the molecular formula C10H10F3NO2 and a molecular weight of 233.19 g/mol. Its IUPAC name is 4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide.

Molecular Properties

Compound Name4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide
PubChem CID10944340
Molecular FormulaC10H10F3NO2
Molecular Weight233.19 g/mol
Exact Mass233.07
IUPAC Name4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide
SMILESNC(=O)C(O)(CC(F)(F)F)c1ccccc1
InChIInChI=1S/C10H10F3NO2/c11-10(12,13)6-9(16,8(14)15)7-4-2-1-3-5-7/h1-5,16H,6H2,(H2,14,15)
InChIKeyFZPZLJQPHYSRPK-UHFFFAOYSA-N
XLogP1.31
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.19
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-Hydroxy-2,2-diphenylacetamide
CID 78483
beta-Ethyl-beta-hydroxybenzenepropanamide
CID 64814
Benzilic acid hydrazide
CID 95968
2-Hydroxy-2-phenylbutyramide
CID 86230
Mandelamide
CID 73558
Atrolactamide
CID 16235
gamma-Hydroxy-gamma-ethyl-gamma-phenylbutyramide
CID 128930
(R)-Mandelamide
CID 441254
2-Hydroxy-2-phenylnonanamide
CID 10131164
beta-Hydroxy-beta-phenylbenzenepropanamide
CID 96551
N-Methylbenzilamide
CID 101230
2-(4-Bromophenyl)-2-hydroxybutanamide
CID 10171492

Frequently Asked Questions

What is the IUPAC name of 4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide?
The IUPAC name of 4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide (CID 10944340) is 4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide.
What is the SMILES notation for 4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide?
The canonical SMILES for 4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide is NC(=O)C(O)(CC(F)(F)F)c1ccccc1.
What is the InChIKey of 4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide?
The InChIKey is FZPZLJQPHYSRPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO2/c11-10(12,13)6-9(16,8(14)15)7-4-2-1-3-5-7/h1-5,16H,6H2,(H2,14,15).
What are the key properties of 4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide?
4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide has a molecular weight of 233.19 g/mol, XLogP of 1.31, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,4-trifluoro-2-hydroxy-2-phenylbutanamide is sourced from PubChem (CID 10944340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).