2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide

C10H10F3NO2 — CID 10879028

IUPAC2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide
SMILESNC(=O)C(O)(Cc1ccccc1)C(F)(F)F
InChIInChI=1S/C10H10F3NO2/c11-10(12,13)9(16,8(14)15)6-7-4-2-1-3-5-7/h1-5,16H,6H2,(H2,14,15)
InChIKeyNNKUYOBVQAYTTP-UHFFFAOYSA-N
MW233.19 g/mol
LogP1.01
Rot. Bonds3

About 2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide

2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide (PubChem CID 10879028) has the molecular formula C10H10F3NO2 and a molecular weight of 233.19 g/mol. Its IUPAC name is 2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide.

Molecular Properties

Compound Name2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide
PubChem CID10879028
Molecular FormulaC10H10F3NO2
Molecular Weight233.19 g/mol
Exact Mass233.07
IUPAC Name2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide
SMILESNC(=O)C(O)(Cc1ccccc1)C(F)(F)F
InChIInChI=1S/C10H10F3NO2/c11-10(12,13)9(16,8(14)15)6-7-4-2-1-3-5-7/h1-5,16H,6H2,(H2,14,15)
InChIKeyNNKUYOBVQAYTTP-UHFFFAOYSA-N
XLogP1.01
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 ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Hydroxy-2,2-diphenylacetamide
CID 78483
2-Hydroxy-2-phenylbutyramide
CID 86230
Atrolactamide
CID 16235
2-Hydroxy-2-phenylnonanamide
CID 10131164
2-Hydroxy-2-phenylundecanamide
CID 12336498
2-Hydroxy-2-phenylpentanamide
CID 5143691
alpha-Trifluoromethyl-alpha-hydroxybenzeneacetamide
CID 10220069
Benzeneacetamide, alpha-hydroxy-alpha-(2,2,2-trifluoroethyl)-
CID 10944340
3-Chloro-3,3-difluoro-2-hydroxy-2-phenylpropanamide
CID 10955535
2-Hydroxy-2-phenylheptanamide
CID 11424567
2-hydroxy-2,3-dihydro-1H-indene-2-carboxamide
CID 12857778
(S)-2-Hydroxy-3-phenylpropanamide
CID 445263

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide?
The IUPAC name of 2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide (CID 10879028) is 2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide.
What is the SMILES notation for 2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide?
The canonical SMILES for 2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide is NC(=O)C(O)(Cc1ccccc1)C(F)(F)F.
What is the InChIKey of 2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide?
The InChIKey is NNKUYOBVQAYTTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO2/c11-10(12,13)9(16,8(14)15)6-7-4-2-1-3-5-7/h1-5,16H,6H2,(H2,14,15).
What are the key properties of 2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide?
2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide has a molecular weight of 233.19 g/mol, XLogP of 1.01, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-3,3,3-trifluoro-2-hydroxypropanamide is sourced from PubChem (CID 10879028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).