2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one

C14H23F3N2O — CID 83250856

IUPAC2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
SMILESCC(C)CC1NC(C2CCCC2)N(CC(F)(F)F)C1=O
InChIInChI=1S/C14H23F3N2O/c1-9(2)7-11-13(20)19(8-14(15,16)17)12(18-11)10-5-3-4-6-10/h9-12,18H,3-8H2,1-2H3
InChIKeyMEMFPERGJUUCCX-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.91
Rot. Bonds4

About 2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one

2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one (PubChem CID 83250856) has the molecular formula C14H23F3N2O and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
PubChem CID83250856
Molecular FormulaC14H23F3N2O
Molecular Weight292.34 g/mol
Exact Mass292.18
IUPAC Name2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
SMILESCC(C)CC1NC(C2CCCC2)N(CC(F)(F)F)C1=O
InChIInChI=1S/C14H23F3N2O/c1-9(2)7-11-13(20)19(8-14(15,16)17)12(18-11)10-5-3-4-6-10/h9-12,18H,3-8H2,1-2H3
InChIKeyMEMFPERGJUUCCX-UHFFFAOYSA-N
XLogP2.91
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one?
The IUPAC name of 2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one (CID 83250856) is 2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one.
What is the SMILES notation for 2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one?
The canonical SMILES for 2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one is CC(C)CC1NC(C2CCCC2)N(CC(F)(F)F)C1=O.
What is the InChIKey of 2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one?
The InChIKey is MEMFPERGJUUCCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F3N2O/c1-9(2)7-11-13(20)19(8-14(15,16)17)12(18-11)10-5-3-4-6-10/h9-12,18H,3-8H2,1-2H3.
What are the key properties of 2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one?
2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one has a molecular weight of 292.34 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5-(2-methylpropyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one is sourced from PubChem (CID 83250856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).