4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one

C14H22F6N2O3 — CID 139925705

IUPAC4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one
SMILESCCC1(C)N(CCOC(F)(F)F)C(=O)N(CCOC(F)(F)F)C1(C)C
InChIInChI=1S/C14H22F6N2O3/c1-5-12(4)11(2,3)21(6-8-24-13(15,16)17)10(23)22(12)7-9-25-14(18,19)20/h5-9H2,1-4H3
InChIKeyFNIHZGQNPNZMCC-UHFFFAOYSA-N
MW380.33 g/mol
LogP3.74
Rot. Bonds7

About 4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one

4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one (PubChem CID 139925705) has the molecular formula C14H22F6N2O3 and a molecular weight of 380.33 g/mol. Its IUPAC name is 4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one
PubChem CID139925705
Molecular FormulaC14H22F6N2O3
Molecular Weight380.33 g/mol
Exact Mass380.15
IUPAC Name4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one
SMILESCCC1(C)N(CCOC(F)(F)F)C(=O)N(CCOC(F)(F)F)C1(C)C
InChIInChI=1S/C14H22F6N2O3/c1-5-12(4)11(2,3)21(6-8-24-13(15,16)17)10(23)22(12)7-9-25-14(18,19)20/h5-9H2,1-4H3
InChIKeyFNIHZGQNPNZMCC-UHFFFAOYSA-N
XLogP3.74
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.33
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-Ethyl-2-methoxybutyl)-3-(2-methoxyethyl)-4-(trifluoromethyl)imidazolidin-2-one
CID 139925602
1,3-Bis(1-fluoro-2-methoxyethyl)-4,5-di(propan-2-yl)imidazolidin-2-one
CID 139925617
1,3-Bis(1-fluoro-2-methoxyethyl)-4,4-di(propan-2-yl)imidazolidin-2-one
CID 139925632
1-(2-Methoxy-2,3-dimethylbutyl)-3-(2-methoxyethyl)-4-(2,2,2-trifluoroethyl)imidazolidin-2-one
CID 139925676
4,4-Diethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one
CID 139925679
1,3-Bis(1-fluoro-2-methoxyethyl)-4,4,5,5-tetrapropylimidazolidin-2-one
CID 139925682
1,3-Bis(1-fluoro-2-methoxyethyl)-4-propan-2-ylimidazolidin-2-one
CID 139925685
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
1,3-Bis(2-methoxypropyl)-4,4,5-tris(1,1,2,2,2-pentafluoroethyl)imidazolidin-2-one
CID 139925698
4-Ethyl-1,3-bis(1-fluoro-2-methoxyethyl)-4-methylimidazolidin-2-one
CID 139925730
1,3-Bis(2-methoxybutyl)-4,4-bis(trifluoromethyl)imidazolidin-2-one
CID 139925734

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one?
The IUPAC name of 4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one (CID 139925705) is 4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one.
What is the SMILES notation for 4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one?
The canonical SMILES for 4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one is CCC1(C)N(CCOC(F)(F)F)C(=O)N(CCOC(F)(F)F)C1(C)C.
What is the InChIKey of 4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one?
The InChIKey is FNIHZGQNPNZMCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22F6N2O3/c1-5-12(4)11(2,3)21(6-8-24-13(15,16)17)10(23)22(12)7-9-25-14(18,19)20/h5-9H2,1-4H3.
What are the key properties of 4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one?
4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one has a molecular weight of 380.33 g/mol, XLogP of 3.74, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-4,5,5-trimethyl-1,3-bis[2-(trifluoromethoxy)ethyl]imidazolidin-2-one is sourced from PubChem (CID 139925705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).