N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide

C7H13F3N2O3 — CID 82721279

IUPACN-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide
SMILESCOCCNC(=O)CNOCC(F)(F)F
InChIInChI=1S/C7H13F3N2O3/c1-14-3-2-11-6(13)4-12-15-5-7(8,9)10/h12H,2-5H2,1H3,(H,11,13)
InChIKeyCBAPUXXZOXGSFE-UHFFFAOYSA-N
MW230.19 g/mol
LogP-0.17
Rot. Bonds7

About N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide

N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide (PubChem CID 82721279) has the molecular formula C7H13F3N2O3 and a molecular weight of 230.19 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide
PubChem CID82721279
Molecular FormulaC7H13F3N2O3
Molecular Weight230.19 g/mol
Exact Mass230.09
IUPAC NameN-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide
SMILESCOCCNC(=O)CNOCC(F)(F)F
InChIInChI=1S/C7H13F3N2O3/c1-14-3-2-11-6(13)4-12-15-5-7(8,9)10/h12H,2-5H2,1H3,(H,11,13)
InChIKeyCBAPUXXZOXGSFE-UHFFFAOYSA-N
XLogP-0.17
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.19
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)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-(2,2,2-trifluoroethoxy)ethyl]acetamide
CID 79281292
N-butyl-2-(2,2,2-trifluoroethoxyamino)acetamide
CID 82722976
2,2,2-trifluoroethyl N-[2-(2-methoxyethylamino)-2-oxoethyl]carbamate
CID 112683708
N-(2-methoxyethyl)-2-[[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]amino]acetamide
CID 113219586
N-[2-(2-methoxyethylamino)ethyl]-3-(2,2,2-trifluoroethoxy)propanamide
CID 113344912
2-(2-methoxyethylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60646688
N-(2-methylbutan-2-yl)-2-(2,2,2-trifluoroethoxyamino)acetamide
CID 82721531
N-[3-(2-methoxyethoxy)propyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78931967
N-[2-(2,2,2-trifluoroethoxyamino)ethyl]acetamide
CID 107529803
methyl 3-(2,2,2-trifluoroethoxyamino)propanoate
CID 82722499
3,3,3-trifluoro-2-[[[2-(2-methoxyethylamino)-2-oxoethyl]amino]methyl]propanoic acid
CID 103263905
2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide
CID 60697905

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide (CID 82721279) is N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide is COCCNC(=O)CNOCC(F)(F)F.
What is the InChIKey of N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide?
The InChIKey is CBAPUXXZOXGSFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F3N2O3/c1-14-3-2-11-6(13)4-12-15-5-7(8,9)10/h12H,2-5H2,1H3,(H,11,13).
What are the key properties of N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide?
N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide has a molecular weight of 230.19 g/mol, XLogP of -0.17, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-(2,2,2-trifluoroethoxyamino)acetamide is sourced from PubChem (CID 82721279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).