1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one

C10H16F3N3O — CID 84804040

IUPAC1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one
SMILESO=C1N(CC(F)(F)F)CCN1C1CCCNC1
InChIInChI=1S/C10H16F3N3O/c11-10(12,13)7-15-4-5-16(9(15)17)8-2-1-3-14-6-8/h8,14H,1-7H2
InChIKeyFXAFLWYRCDMFMZ-UHFFFAOYSA-N
MW251.25 g/mol
LogP1.04
Rot. Bonds2

About 1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one

1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one (PubChem CID 84804040) has the molecular formula C10H16F3N3O and a molecular weight of 251.25 g/mol. Its IUPAC name is 1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one
PubChem CID84804040
Molecular FormulaC10H16F3N3O
Molecular Weight251.25 g/mol
Exact Mass251.12
IUPAC Name1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one
SMILESO=C1N(CC(F)(F)F)CCN1C1CCCNC1
InChIInChI=1S/C10H16F3N3O/c11-10(12,13)7-15-4-5-16(9(15)17)8-2-1-3-14-6-8/h8,14H,1-7H2
InChIKeyFXAFLWYRCDMFMZ-UHFFFAOYSA-N
XLogP1.04
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.25
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one?
The IUPAC name of 1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one (CID 84804040) is 1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one.
What is the SMILES notation for 1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one?
The canonical SMILES for 1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one is O=C1N(CC(F)(F)F)CCN1C1CCCNC1.
What is the InChIKey of 1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one?
The InChIKey is FXAFLWYRCDMFMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3N3O/c11-10(12,13)7-15-4-5-16(9(15)17)8-2-1-3-14-6-8/h8,14H,1-7H2.
What are the key properties of 1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one?
1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one has a molecular weight of 251.25 g/mol, XLogP of 1.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-3-yl-3-(2,2,2-trifluoroethyl)imidazolidin-2-one is sourced from PubChem (CID 84804040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).