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

C13H21F3N2O — CID 83251613

IUPAC2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
SMILESCCCC1NC(C2CCCC2)N(CC(F)(F)F)C1=O
InChIInChI=1S/C13H21F3N2O/c1-2-5-10-12(19)18(8-13(14,15)16)11(17-10)9-6-3-4-7-9/h9-11,17H,2-8H2,1H3
InChIKeySCQCBXFECFKFQS-UHFFFAOYSA-N
MW278.32 g/mol
LogP2.67
Rot. Bonds4

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

2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one (PubChem CID 83251613) has the molecular formula C13H21F3N2O and a molecular weight of 278.32 g/mol. Its IUPAC name is 2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
PubChem CID83251613
Molecular FormulaC13H21F3N2O
Molecular Weight278.32 g/mol
Exact Mass278.16
IUPAC Name2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
SMILESCCCC1NC(C2CCCC2)N(CC(F)(F)F)C1=O
InChIInChI=1S/C13H21F3N2O/c1-2-5-10-12(19)18(8-13(14,15)16)11(17-10)9-6-3-4-7-9/h9-11,17H,2-8H2,1H3
InChIKeySCQCBXFECFKFQS-UHFFFAOYSA-N
XLogP2.67
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.32
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-3,5-dipropylimidazolidin-4-one
CID 83242252
2-cyclopentyl-5-propyl-3-[2-(trifluoromethylsulfanyl)ethyl]imidazolidin-4-one
CID 106433274
2-cyclopentyl-3-[(1-methylcyclopentyl)methyl]-5-propylimidazolidin-4-one
CID 83262733
2-cyclopentyl-5-ethyl-3-(3,3,3-trifluoropropyl)imidazolidin-4-one
CID 83255350
2-cyclopentyl-3-(2-methyl-3-methylsulfanylpropyl)-5-propylimidazolidin-4-one
CID 83256963
2-cyclopentyl-3-(4-methoxybutyl)-5-propylimidazolidin-4-one
CID 83246103
2-cyclopentyl-3-(2-cyclopentylethyl)-5-ethylimidazolidin-4-one
CID 83255960
2-cyclopentyl-3-[2-(dimethylamino)-2-methylpropyl]-5-ethylimidazolidin-4-one
CID 83252179
2-(4-chlorophenyl)-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
CID 83244948
2-cyclopentyl-3-(7-oxabicyclo[2.2.1]heptan-2-yl)-5-propylimidazolidin-4-one
CID 83267451
2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one
CID 83244779
methyl 3-(4-butyl-2-cyclopentyl-5-oxoimidazolidin-1-yl)propanoate
CID 83247573

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one?
The IUPAC name of 2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one (CID 83251613) is 2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one.
What is the SMILES notation for 2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one?
The canonical SMILES for 2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one is CCCC1NC(C2CCCC2)N(CC(F)(F)F)C1=O.
What is the InChIKey of 2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one?
The InChIKey is SCQCBXFECFKFQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21F3N2O/c1-2-5-10-12(19)18(8-13(14,15)16)11(17-10)9-6-3-4-7-9/h9-11,17H,2-8H2,1H3.
What are the key properties of 2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one?
2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one has a molecular weight of 278.32 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5-propyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one is sourced from PubChem (CID 83251613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).