2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine

C10H17F5N2O2 — CID 139932596

IUPAC2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine
SMILESCOCCN1CCN(CC(C)OC(F)(F)F)C1(F)F
InChIInChI=1S/C10H17F5N2O2/c1-8(19-9(11,12)13)7-17-4-3-16(5-6-18-2)10(17,14)15/h8H,3-7H2,1-2H3
InChIKeyBMGMEYGVHCHLJS-UHFFFAOYSA-N
MW292.25 g/mol
LogP1.73
Rot. Bonds6

About 2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine

2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine (PubChem CID 139932596) has the molecular formula C10H17F5N2O2 and a molecular weight of 292.25 g/mol. Its IUPAC name is 2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine.

Molecular Properties

Compound Name2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine
PubChem CID139932596
Molecular FormulaC10H17F5N2O2
Molecular Weight292.25 g/mol
Exact Mass292.12
IUPAC Name2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine
SMILESCOCCN1CCN(CC(C)OC(F)(F)F)C1(F)F
InChIInChI=1S/C10H17F5N2O2/c1-8(19-9(11,12)13)7-17-4-3-16(5-6-18-2)10(17,14)15/h8H,3-7H2,1-2H3
InChIKeyBMGMEYGVHCHLJS-UHFFFAOYSA-N
XLogP1.73
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.25
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze 2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine?
The IUPAC name of 2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine (CID 139932596) is 2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine.
What is the SMILES notation for 2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine?
The canonical SMILES for 2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine is COCCN1CCN(CC(C)OC(F)(F)F)C1(F)F.
What is the InChIKey of 2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine?
The InChIKey is BMGMEYGVHCHLJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F5N2O2/c1-8(19-9(11,12)13)7-17-4-3-16(5-6-18-2)10(17,14)15/h8H,3-7H2,1-2H3.
What are the key properties of 2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine?
2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine has a molecular weight of 292.25 g/mol, XLogP of 1.73, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine is sourced from PubChem (CID 139932596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).