2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine

C13H26F2N2O2 — CID 139932625

IUPAC2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine
SMILESCCCOCCN1CCN(CCOCCC)C1(F)F
InChIInChI=1S/C13H26F2N2O2/c1-3-9-18-11-7-16-5-6-17(13(16,14)15)8-12-19-10-4-2/h3-12H2,1-2H3
InChIKeyWXEQWFHTNLBZKA-UHFFFAOYSA-N
MW280.36 g/mol
LogP2.01
Rot. Bonds10

About 2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine

2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine (PubChem CID 139932625) has the molecular formula C13H26F2N2O2 and a molecular weight of 280.36 g/mol. Its IUPAC name is 2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine.

Molecular Properties

Compound Name2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine
PubChem CID139932625
Molecular FormulaC13H26F2N2O2
Molecular Weight280.36 g/mol
Exact Mass280.20
IUPAC Name2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine
SMILESCCCOCCN1CCN(CCOCCC)C1(F)F
InChIInChI=1S/C13H26F2N2O2/c1-3-9-18-11-7-16-5-6-17(13(16,14)15)8-12-19-10-4-2/h3-12H2,1-2H3
InChIKeyWXEQWFHTNLBZKA-UHFFFAOYSA-N
XLogP2.01
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.36
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-Fluoro-1-methyl-3-[1,1,2-trifluoro-2-(trifluoromethoxy)ethyl]imidazolidine
CID 87123494
4,4,5-Trifluoro-1,3-bis(2-methoxyethyl)imidazolidin-2-one
CID 139925607
1,3-Bis[2-(2,2,2-trifluoroethoxy)ethyl]imidazolidin-2-one
CID 139925683
4,4-Difluoro-1,3-bis(2-methoxyethyl)imidazolidin-2-one
CID 139925702
1,3-Bis[2-(1,1,2,2,3,3,3-heptafluoropropoxy)ethyl]imidazolidin-2-one
CID 139925703
4,5-Difluoro-1,3-bis(2-methoxyethyl)imidazolidin-2-one
CID 139925724
2,2-Difluoro-1-(2-methoxyethyl)-3-propylimidazolidine
CID 139932589
2,2-Difluoro-1,3-bis[2-(fluoromethoxy)ethyl]imidazolidine
CID 139932594
2,2-Difluoro-1-(2-methoxyethyl)-3-(2-methoxy-2-methylpropyl)imidazolidine
CID 139932595
2,2-Difluoro-1-(2-methoxyethyl)-3-[2-(trifluoromethoxy)propyl]imidazolidine
CID 139932596
4-Ethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)-4-methylimidazolidine
CID 139932597
1,3-Bis(1,1-difluoro-2-methoxyethyl)-2,2,4-trifluoro-5-iodoimidazolidine
CID 139932606

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine?
The IUPAC name of 2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine (CID 139932625) is 2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine.
What is the SMILES notation for 2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine?
The canonical SMILES for 2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine is CCCOCCN1CCN(CCOCCC)C1(F)F.
What is the InChIKey of 2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine?
The InChIKey is WXEQWFHTNLBZKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26F2N2O2/c1-3-9-18-11-7-16-5-6-17(13(16,14)15)8-12-19-10-4-2/h3-12H2,1-2H3.
What are the key properties of 2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine?
2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine has a molecular weight of 280.36 g/mol, XLogP of 2.01, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-1,3-bis(2-propoxyethyl)imidazolidine is sourced from PubChem (CID 139932625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).