2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide

C11H12F3NO2 — CID 71371552

IUPAC2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
SMILESCC(C)(O)C(=O)Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C11H12F3NO2/c1-10(2,17)9(16)15-8-5-3-4-7(6-8)11(12,13)14/h3-6,17H,1-2H3,(H,15,16)
InChIKeyDOFAKQUGUJXYPV-UHFFFAOYSA-N
MW247.22 g/mol
LogP2.41
Rot. Bonds2

About 2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide

2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide (PubChem CID 71371552) has the molecular formula C11H12F3NO2 and a molecular weight of 247.22 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide.

Molecular Properties

Compound Name2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
PubChem CID71371552
Molecular FormulaC11H12F3NO2
Molecular Weight247.22 g/mol
Exact Mass247.08
IUPAC Name2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
SMILESCC(C)(O)C(=O)Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C11H12F3NO2/c1-10(2,17)9(16)15-8-5-3-4-7(6-8)11(12,13)14/h3-6,17H,1-2H3,(H,15,16)
InChIKeyDOFAKQUGUJXYPV-UHFFFAOYSA-N
XLogP2.41
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.22
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-3,3,3-trifluoro-2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 10542294
2,2-dimethyl-N-[3-(trifluoromethyl)phenyl]butanamide
CID 669889
2,2-dimethyl-N-propan-2-yl-N'-[3-(trifluoromethyl)phenyl]propanediamide
CID 108957311
N-(4-tert-butylphenyl)-N'-[3-(trifluoromethyl)phenyl]oxamide
CID 108501438
3-benzylsulfonyl-2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 3598782
N-[3-[[3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]acetamide
CID 970620
1-hydroxy-3-[3-(trifluoromethyl)phenyl]urea
CID 4106892
N-(2,3-dimethylphenyl)-2,2-dimethyl-N'-[3-(trifluoromethyl)phenyl]propanediamide
CID 108968157
N-(3-chloro-4-methylphenyl)-2,2-dimethyl-N'-[3-(trifluoromethyl)phenyl]propanediamide
CID 108969164
N-[3-bromo-5-(trifluoromethyl)phenyl]-2-hydroxy-2-methylpropanamide
CID 103430139
2-oxo-N-[3-(trifluoromethyl)phenyl]propanethioamide
CID 141059114
2-hydroxy-2-methyl-3-(4-methylphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 3512423

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide?
The IUPAC name of 2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide (CID 71371552) is 2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide.
What is the SMILES notation for 2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide?
The canonical SMILES for 2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide is CC(C)(O)C(=O)Nc1cccc(C(F)(F)F)c1.
What is the InChIKey of 2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide?
The InChIKey is DOFAKQUGUJXYPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3NO2/c1-10(2,17)9(16)15-8-5-3-4-7(6-8)11(12,13)14/h3-6,17H,1-2H3,(H,15,16).
What are the key properties of 2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide?
2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide has a molecular weight of 247.22 g/mol, XLogP of 2.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide is sourced from PubChem (CID 71371552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).