2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide

C12H12F4N2O3 — CID 103732513

IUPAC2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide
SMILESCOCC(=O)Nc1ccc(NC(=O)C(F)(F)C(F)F)cc1
InChIInChI=1S/C12H12F4N2O3/c1-21-6-9(19)17-7-2-4-8(5-3-7)18-11(20)12(15,16)10(13)14/h2-5,10H,6H2,1H3,(H,17,19)(H,18,20)
InChIKeyJTIZJIRZFJYERT-UHFFFAOYSA-N
MW308.23 g/mol
LogP2.11
Rot. Bonds6

About 2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide

2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide (PubChem CID 103732513) has the molecular formula C12H12F4N2O3 and a molecular weight of 308.23 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide.

Molecular Properties

Compound Name2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide
PubChem CID103732513
Molecular FormulaC12H12F4N2O3
Molecular Weight308.23 g/mol
Exact Mass308.08
IUPAC Name2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide
SMILESCOCC(=O)Nc1ccc(NC(=O)C(F)(F)C(F)F)cc1
InChIInChI=1S/C12H12F4N2O3/c1-21-6-9(19)17-7-2-4-8(5-3-7)18-11(20)12(15,16)10(13)14/h2-5,10H,6H2,1H3,(H,17,19)(H,18,20)
InChIKeyJTIZJIRZFJYERT-UHFFFAOYSA-N
XLogP2.11
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.23
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]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

N-(4-acetamidophenyl)-2,2,3,3-tetrafluoropropanamide
CID 103731824
N-(4-ethylphenyl)-2,2,3,3-tetrafluoropropanamide
CID 103731916
2,2,3,3-tetrafluoro-N-(4-fluorophenyl)propanamide
CID 103731851
2-methoxy-N-[4-(trifluoromethylsulfanyl)phenyl]acetamide
CID 60719081
2,2,3,3-tetrafluoro-N-[6-(2-methoxyethoxy)-3-pyridinyl]propanamide
CID 103732741
2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 43708154
N-(4-hydrazinylphenyl)-2-methoxyacetamide
CID 141361616
2-methoxy-N-[4-(pentafluoro-λ6-sulfanyl)phenyl]acetamide
CID 177288026
2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylpentanamide
CID 60848779
N-[4-(hydroxymethyl)phenyl]-2-methoxyacetamide
CID 64794296
ethane;2-methoxy-N-phenylacetamide;yttrium
CID 159976159
N-[4-[(2-methoxyacetyl)amino]phenyl]-2-methylbutanamide
CID 42948482

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide?
The IUPAC name of 2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide (CID 103732513) is 2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide.
What is the SMILES notation for 2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide?
The canonical SMILES for 2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide is COCC(=O)Nc1ccc(NC(=O)C(F)(F)C(F)F)cc1.
What is the InChIKey of 2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide?
The InChIKey is JTIZJIRZFJYERT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F4N2O3/c1-21-6-9(19)17-7-2-4-8(5-3-7)18-11(20)12(15,16)10(13)14/h2-5,10H,6H2,1H3,(H,17,19)(H,18,20).
What are the key properties of 2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide?
2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide has a molecular weight of 308.23 g/mol, XLogP of 2.11, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetrafluoro-N-[4-[(2-methoxyacetyl)amino]phenyl]propanamide is sourced from PubChem (CID 103732513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).