2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide

C10H10F3NO2 — CID 15653812

IUPAC2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide
SMILESO=C(N[C@@H](CO)c1ccccc1)C(F)(F)F
InChIInChI=1S/C10H10F3NO2/c11-10(12,13)9(16)14-8(6-15)7-4-2-1-3-5-7/h1-5,8,15H,6H2,(H,14,16)/t8-/m0/s1
InChIKeyYPUDARQIQJYYCH-QMMMGPOBSA-N
MW233.19 g/mol
LogP1.40
Rot. Bonds3

About 2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide

2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide (PubChem CID 15653812) has the molecular formula C10H10F3NO2 and a molecular weight of 233.19 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide
PubChem CID15653812
Molecular FormulaC10H10F3NO2
Molecular Weight233.19 g/mol
Exact Mass233.07
IUPAC Name2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide
SMILESO=C(N[C@@H](CO)c1ccccc1)C(F)(F)F
InChIInChI=1S/C10H10F3NO2/c11-10(12,13)9(16)14-8(6-15)7-4-2-1-3-5-7/h1-5,8,15H,6H2,(H,14,16)/t8-/m0/s1
InChIKeyYPUDARQIQJYYCH-QMMMGPOBSA-N
XLogP1.40
TPSA49.33 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 ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-2,2-difluoro-N-[(1S)-2-hydroxy-1-phenylethyl]acetamide
CID 40562691
N-[(1S)-2-(benzylamino)-1-phenylethyl]-2,2,2-trifluoroacetamide
CID 130678853
2-amino-2-ethyl-N-(2-hydroxy-1-phenylethyl)butanamide
CID 79812629
(2R)-N-[(1S)-2-hydroxy-1-phenylethyl]-2,5,5-trimethyl-2-phenylhexanamide
CID 25259507
N-[(1R)-2-hydroxy-1-phenylethyl]-2-(trifluoromethyl)benzamide
CID 40548744
methyl (E)-4,4,4-trifluoro-3-[[(1S)-2-hydroxy-1-phenylethyl]amino]but-2-enoate
CID 102287562
N-(2-hydroxy-1-phenylethyl)benzamide
CID 14150746
2-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]prop-2-enamide
CID 167776266
2,2,2-trifluoro-N-(3-oxo-1-phenyl-3-piperidin-1-ylpropyl)acetamide
CID 51063364
N-[(1S)-2-hydroxy-1-phenylethyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 103945351
2-cyano-2-ethyl-N-[(1R)-2-hydroxy-1-phenylethyl]butanamide
CID 107863395
(2S)-2-hydroxy-N-(2-hydroxy-1-phenylethyl)-2-phenylacetamide
CID 75483745

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide (CID 15653812) is 2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide is O=C(N[C@@H](CO)c1ccccc1)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide?
The InChIKey is YPUDARQIQJYYCH-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H10F3NO2/c11-10(12,13)9(16)14-8(6-15)7-4-2-1-3-5-7/h1-5,8,15H,6H2,(H,14,16)/t8-/m0/s1.
What are the key properties of 2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide?
2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide has a molecular weight of 233.19 g/mol, XLogP of 1.40, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide is sourced from PubChem (CID 15653812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).