N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide

C7H12F3NO2 — CID 130290994

IUPACN-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCON(CC(F)(F)F)C(=O)C(C)C
InChIInChI=1S/C7H12F3NO2/c1-5(2)6(12)11(13-3)4-7(8,9)10/h5H,4H2,1-3H3
InChIKeyWLTZKCVZZDMNKD-UHFFFAOYSA-N
MW199.17 g/mol
LogP1.59
Rot. Bonds3

About N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide

N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 130290994) has the molecular formula C7H12F3NO2 and a molecular weight of 199.17 g/mol. Its IUPAC name is N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound NameN-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID130290994
Molecular FormulaC7H12F3NO2
Molecular Weight199.17 g/mol
Exact Mass199.08
IUPAC NameN-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCON(CC(F)(F)F)C(=O)C(C)C
InChIInChI=1S/C7H12F3NO2/c1-5(2)6(12)11(13-3)4-7(8,9)10/h5H,4H2,1-3H3
InChIKeyWLTZKCVZZDMNKD-UHFFFAOYSA-N
XLogP1.59
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.17
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide 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-difluoro-N-methoxy-N-methylpropanamide
CID 58736313
2,2,2-trifluoro-N-isobutylacetohydroxamic acid
CID 129804035
N-Methyl-N-methoxy-bistrifluoromethylacetamide
CID 548349
3,3,3-Trifluoro-N-methoxy-N-methylpropanamide
CID 53403832
N-ethyl-2,2,2-trifluoro-N-methoxyacetamide
CID 59512182
N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide
CID 60758557
3,3,3-Trifluoro-N-methoxy-N,2,2-trimethylpropanamide
CID 86650577
N-ethyl-2,2-difluoro-N-hydroxypropanamide
CID 88626311
N-(2,2-difluoroethyl)-N,2-dimethylpropanamide
CID 115611576
4,4,4-trifluoro-N-methoxy-N,3-dimethylbutanamide
CID 129050719
N-hydroxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
CID 130291222
N-ethoxy-2,2-difluoro-N-methylpropanamide
CID 131200737

Frequently Asked Questions

What is the IUPAC name of N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide (CID 130290994) is N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide is CON(CC(F)(F)F)C(=O)C(C)C.
What is the InChIKey of N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is WLTZKCVZZDMNKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F3NO2/c1-5(2)6(12)11(13-3)4-7(8,9)10/h5H,4H2,1-3H3.
What are the key properties of N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide?
N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 199.17 g/mol, XLogP of 1.59, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-2-methyl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 130290994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).