2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine

C10H16F8N2O3 — CID 131974281

IUPAC2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine
SMILESCN(C)C(F)C(F)(F)OCCOCCOC(F)(F)C(F)N(F)F
InChIInChI=1S/C10H16F8N2O3/c1-19(2)7(11)9(13,14)22-5-3-21-4-6-23-10(15,16)8(12)20(17)18/h7-8H,3-6H2,1-2H3
InChIKeyFAWYWVVFZBLQPJ-UHFFFAOYSA-N
MW364.23 g/mol
LogP2.45
Rot. Bonds12

About 2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine

2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine (PubChem CID 131974281) has the molecular formula C10H16F8N2O3 and a molecular weight of 364.23 g/mol. Its IUPAC name is 2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine
PubChem CID131974281
Molecular FormulaC10H16F8N2O3
Molecular Weight364.23 g/mol
Exact Mass364.10
IUPAC Name2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine
SMILESCN(C)C(F)C(F)(F)OCCOCCOC(F)(F)C(F)N(F)F
InChIInChI=1S/C10H16F8N2O3/c1-19(2)7(11)9(13,14)22-5-3-21-4-6-23-10(15,16)8(12)20(17)18/h7-8H,3-6H2,1-2H3
InChIKeyFAWYWVVFZBLQPJ-UHFFFAOYSA-N
XLogP2.45
TPSA34.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.23
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine
CID 141061045
2-[2-[2-[2-[2-(2,2-difluoroethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1,1-difluoroethane
CID 170162541
2-methyl-2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane
CID 134597159
2-(2-butoxyethoxy)-1,1,2,2-tetrafluoroethanol
CID 18995460
1-ethoxy-2-(trifluoromethoxy)ethane
CID 87162422
1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]ethoxy]ethanol
CID 170282513
2-[2-[2-[2-[2-[2-[2-(trifluoromethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 87962510
2-[2-[2-(trifluoromethoxy)ethoxy]ethoxy]ethanamine
CID 118166069
3-(2,2-difluoroethoxy)-1,1,1-trifluoropropane
CID 126707171
1,1,2,4,4,4-hexafluoro-1-propoxybutane
CID 175770445
1,1,1-trifluoro-2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethane
CID 87282326
1-amino-1-[2-[2-(trifluoromethoxy)ethoxy]ethoxy]propan-2-ol
CID 118166078

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine?
The IUPAC name of 2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine (CID 131974281) is 2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine.
What is the SMILES notation for 2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine?
The canonical SMILES for 2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine is CN(C)C(F)C(F)(F)OCCOCCOC(F)(F)C(F)N(F)F.
What is the InChIKey of 2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine?
The InChIKey is FAWYWVVFZBLQPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F8N2O3/c1-19(2)7(11)9(13,14)22-5-3-21-4-6-23-10(15,16)8(12)20(17)18/h7-8H,3-6H2,1-2H3.
What are the key properties of 2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine?
2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine has a molecular weight of 364.23 g/mol, XLogP of 2.45, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine is sourced from PubChem (CID 131974281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).