2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine

C17H14F6N2O — CID 158012039

IUPAC2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine
SMILESCCOC1N(c2c(F)cc(F)cc2F)CCN1c1c(F)cc(F)cc1F
InChIInChI=1S/C17H14F6N2O/c1-2-26-17-24(15-11(20)5-9(18)6-12(15)21)3-4-25(17)16-13(22)7-10(19)8-14(16)23/h5-8,17H,2-4H2,1H3
InChIKeyFEZVYEMBGPCRIW-UHFFFAOYSA-N
MW376.30 g/mol
LogP4.17
Rot. Bonds4

About 2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine

2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine (PubChem CID 158012039) has the molecular formula C17H14F6N2O and a molecular weight of 376.30 g/mol. Its IUPAC name is 2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine.

Molecular Properties

Compound Name2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine
PubChem CID158012039
Molecular FormulaC17H14F6N2O
Molecular Weight376.30 g/mol
Exact Mass376.10
IUPAC Name2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine
SMILESCCOC1N(c2c(F)cc(F)cc2F)CCN1c1c(F)cc(F)cc1F
InChIInChI=1S/C17H14F6N2O/c1-2-26-17-24(15-11(20)5-9(18)6-12(15)21)3-4-25(17)16-13(22)7-10(19)8-14(16)23/h5-8,17H,2-4H2,1H3
InChIKeyFEZVYEMBGPCRIW-UHFFFAOYSA-N
XLogP4.17
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.30
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine?
The IUPAC name of 2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine (CID 158012039) is 2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine.
What is the SMILES notation for 2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine?
The canonical SMILES for 2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine is CCOC1N(c2c(F)cc(F)cc2F)CCN1c1c(F)cc(F)cc1F.
What is the InChIKey of 2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine?
The InChIKey is FEZVYEMBGPCRIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F6N2O/c1-2-26-17-24(15-11(20)5-9(18)6-12(15)21)3-4-25(17)16-13(22)7-10(19)8-14(16)23/h5-8,17H,2-4H2,1H3.
What are the key properties of 2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine?
2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine has a molecular weight of 376.30 g/mol, XLogP of 4.17, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1,3-bis(2,4,6-trifluorophenyl)imidazolidine is sourced from PubChem (CID 158012039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).