2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide

C14H19F3N2O3 — CID 119769290

IUPAC2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide
SMILESCOCCNCC(=O)NCC(O)(c1ccccc1)C(F)(F)F
InChIInChI=1S/C14H19F3N2O3/c1-22-8-7-18-9-12(20)19-10-13(21,14(15,16)17)11-5-3-2-4-6-11/h2-6,18,21H,7-10H2,1H3,(H,19,20)
InChIKeyHCFPTXYLXAIHIO-UHFFFAOYSA-N
MW320.31 g/mol
LogP0.79
Rot. Bonds8

About 2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide

2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide (PubChem CID 119769290) has the molecular formula C14H19F3N2O3 and a molecular weight of 320.31 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide
PubChem CID119769290
Molecular FormulaC14H19F3N2O3
Molecular Weight320.31 g/mol
Exact Mass320.13
IUPAC Name2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide
SMILESCOCCNCC(=O)NCC(O)(c1ccccc1)C(F)(F)F
InChIInChI=1S/C14H19F3N2O3/c1-22-8-7-18-9-12(20)19-10-13(21,14(15,16)17)11-5-3-2-4-6-11/h2-6,18,21H,7-10H2,1H3,(H,19,20)
InChIKeyHCFPTXYLXAIHIO-UHFFFAOYSA-N
XLogP0.79
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.31
LogP ≤ 50.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide 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-(2-methoxyethylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60646688
2-(3,4-dimethoxyphenyl)-N-[(2S)-3,3,3-trifluoro-2-hydroxy-2-phenylpropyl]acetamide
CID 95376510
2-amino-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide;hydrochloride
CID 119315270
2-(2-methoxyethylamino)-N-[[2-(trifluoromethyl)phenyl]methyl]acetamide
CID 79282836
2-(2-methoxyethylamino)-N-[2-methyl-2-(3-methylphenyl)propyl]acetamide;hydrochloride
CID 119757019
N-[2-(2-chlorophenyl)-2-methylpropyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119773052
N-(2-methoxyethyl)-2-[[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]amino]acetamide
CID 113219586
2-(benzylamino)-N-(2-methoxyethyl)acetamide
CID 54813572
2-(2-methoxyethylamino)-1-[2-(trifluoromethyl)phenyl]ethanone
CID 116591610
2-(2-methoxyethylamino)-N-[[1-[3-(trifluoromethyl)phenyl]cyclopropyl]methyl]acetamide
CID 119772784
2-(4-fluorophenyl)sulfanyl-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide
CID 71781980
2-(4-fluorophenoxy)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide
CID 90497968

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide?
The IUPAC name of 2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide (CID 119769290) is 2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide?
The canonical SMILES for 2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide is COCCNCC(=O)NCC(O)(c1ccccc1)C(F)(F)F.
What is the InChIKey of 2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide?
The InChIKey is HCFPTXYLXAIHIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2O3/c1-22-8-7-18-9-12(20)19-10-13(21,14(15,16)17)11-5-3-2-4-6-11/h2-6,18,21H,7-10H2,1H3,(H,19,20).
What are the key properties of 2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide?
2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide has a molecular weight of 320.31 g/mol, XLogP of 0.79, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)acetamide is sourced from PubChem (CID 119769290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).