4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine

C17H34F2N2O2 — CID 139932655

IUPAC4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine
SMILESCCC1(CC)N(CCOC)C(F)(F)N(CCOC)C1(CC)CC
InChIInChI=1S/C17H34F2N2O2/c1-7-15(8-2)16(9-3,10-4)21(12-14-23-6)17(18,19)20(15)11-13-22-5/h7-14H2,1-6H3
InChIKeyNKGIOLVABWYTEO-UHFFFAOYSA-N
MW336.47 g/mol
LogP3.56
Rot. Bonds10

About 4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine

4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine (PubChem CID 139932655) has the molecular formula C17H34F2N2O2 and a molecular weight of 336.47 g/mol. Its IUPAC name is 4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine.

Molecular Properties

Compound Name4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine
PubChem CID139932655
Molecular FormulaC17H34F2N2O2
Molecular Weight336.47 g/mol
Exact Mass336.26
IUPAC Name4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine
SMILESCCC1(CC)N(CCOC)C(F)(F)N(CCOC)C1(CC)CC
InChIInChI=1S/C17H34F2N2O2/c1-7-15(8-2)16(9-3,10-4)21(12-14-23-6)17(18,19)20(15)11-13-22-5/h7-14H2,1-6H3
InChIKeyNKGIOLVABWYTEO-UHFFFAOYSA-N
XLogP3.56
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.47
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1,3-Bis(1-fluoro-2-methoxyethyl)-4,4-di(propan-2-yl)imidazolidin-2-one
CID 139925632
1,3-Bis(1-fluoro-2-methoxyethyl)-4,4,5,5-tetrapropylimidazolidin-2-one
CID 139925682
1,3-Bis(1-fluoro-2-methoxyethyl)-4,4,5-tris(1,1,1-trifluoropropan-2-yl)imidazolidin-2-one
CID 139925686
4,5-Diethyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yl)-1,3-bis(2-methoxybutyl)imidazolidin-2-one
CID 139925693
4-Ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one
CID 139925705
1,3-Bis(1-fluoro-2-methoxyethyl)-4,4,5,5-tetra(propan-2-yl)imidazolidin-2-one
CID 139925736
4,5-Diethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)-4,5-dimethylimidazolidine
CID 139932593
4-Ethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)-4-methylimidazolidine
CID 139932597
2,2-Difluoro-1,3-bis(4-methoxyhexan-3-yl)-4,4,5,5-tetramethylimidazolidine
CID 139932598
2,2-Difluoro-1,3-bis(1-fluoro-2-methoxyethyl)-4,4,5-tripropylimidazolidine
CID 139932609
4,4,5,5-Tetraethyl-2,2-difluoro-1,3-bis(2-methoxypentan-3-yl)imidazolidine
CID 139932621
2,2-Difluoro-1,3-bis(2-methoxyethyl)-4,4,5-tri(propan-2-yl)imidazolidine
CID 139932622

Frequently Asked Questions

What is the IUPAC name of 4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine?
The IUPAC name of 4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine (CID 139932655) is 4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine.
What is the SMILES notation for 4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine?
The canonical SMILES for 4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine is CCC1(CC)N(CCOC)C(F)(F)N(CCOC)C1(CC)CC.
What is the InChIKey of 4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine?
The InChIKey is NKGIOLVABWYTEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34F2N2O2/c1-7-15(8-2)16(9-3,10-4)21(12-14-23-6)17(18,19)20(15)11-13-22-5/h7-14H2,1-6H3.
What are the key properties of 4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine?
4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine has a molecular weight of 336.47 g/mol, XLogP of 3.56, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,5,5-tetraethyl-2,2-difluoro-1,3-bis(2-methoxyethyl)imidazolidine is sourced from PubChem (CID 139932655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).