2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide

C10H11F3N2O2 — CID 116684979

IUPAC2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
SMILESNC(=O)C(NCC(F)(F)F)c1ccccc1O
InChIInChI=1S/C10H11F3N2O2/c11-10(12,13)5-15-8(9(14)17)6-3-1-2-4-7(6)16/h1-4,8,15-16H,5H2,(H2,14,17)
InChIKeyRXSJVCCOWOCHAS-UHFFFAOYSA-N
MW248.20 g/mol
LogP1.07
Rot. Bonds4

About 2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide

2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 116684979) has the molecular formula C10H11F3N2O2 and a molecular weight of 248.20 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID116684979
Molecular FormulaC10H11F3N2O2
Molecular Weight248.20 g/mol
Exact Mass248.08
IUPAC Name2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
SMILESNC(=O)C(NCC(F)(F)F)c1ccccc1O
InChIInChI=1S/C10H11F3N2O2/c11-10(12,13)5-15-8(9(14)17)6-3-1-2-4-7(6)16/h1-4,8,15-16H,5H2,(H2,14,17)
InChIKeyRXSJVCCOWOCHAS-UHFFFAOYSA-N
XLogP1.07
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.20
LogP ≤ 51.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

Ethylenediaminedi-o-hydroxyphenylacetic acid
CID 14432
N-Acetyl-L-tyrosinamide
CID 735956
3-(2-Hydroxy-4,5-dimethylphenyl)-3-(trifluoromethyl)piperazin-2-one
CID 3241768
[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-(2-hydroxy-phenyl)-acetic acid
CID 15516232
Benzamide, N-(2-amino-2-oxoethyl)-2-hydroxy-
CID 3043784
Glycyl-L-tyrosinamide
CID 101187
l-Tyrosylglycinamide
CID 7015187
Benzenepropanamide, alpha-((2-hydroxybenzoyl)amino)-
CID 64888
Benzamide, N-(2-amino-1-methyl-2-oxoethyl)-2-hydroxy-
CID 3043787
Benzamide, N-(2-(diethylamino)-1-methyl-2-oxoethyl)-2-hydroxy-
CID 3043788
2-acetamido-N-benzyl-2-(2-hydroxy-5-methylphenyl)acetamide
CID 14212844
(S)-2-benzylamino-N-hydroxy-3-(4-hydroxyphenyl)propanamide
CID 16094827

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of 2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide (CID 116684979) is 2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for 2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for 2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide is NC(=O)C(NCC(F)(F)F)c1ccccc1O.
What is the InChIKey of 2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is RXSJVCCOWOCHAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O2/c11-10(12,13)5-15-8(9(14)17)6-3-1-2-4-7(6)16/h1-4,8,15-16H,5H2,(H2,14,17).
What are the key properties of 2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide?
2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 248.20 g/mol, XLogP of 1.07, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 116684979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).