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

C15H25F3N2O — CID 83250189

IUPAC2-cyclopentyl-5-(2-methylpropyl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one
SMILESCC(C)CC1NC(C2CCCC2)N(CCC(F)(F)F)C1=O
InChIInChI=1S/C15H25F3N2O/c1-10(2)9-12-14(21)20(8-7-15(16,17)18)13(19-12)11-5-3-4-6-11/h10-13,19H,3-9H2,1-2H3
InChIKeyUSJYRTGYACUMRP-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.30
Rot. Bonds5

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

2-cyclopentyl-5-(2-methylpropyl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one (PubChem CID 83250189) has the molecular formula C15H25F3N2O and a molecular weight of 306.37 g/mol. Its IUPAC name is 2-cyclopentyl-5-(2-methylpropyl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-cyclopentyl-5-(2-methylpropyl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one
PubChem CID83250189
Molecular FormulaC15H25F3N2O
Molecular Weight306.37 g/mol
Exact Mass306.19
IUPAC Name2-cyclopentyl-5-(2-methylpropyl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one
SMILESCC(C)CC1NC(C2CCCC2)N(CCC(F)(F)F)C1=O
InChIInChI=1S/C15H25F3N2O/c1-10(2)9-12-14(21)20(8-7-15(16,17)18)13(19-12)11-5-3-4-6-11/h10-13,19H,3-9H2,1-2H3
InChIKeyUSJYRTGYACUMRP-UHFFFAOYSA-N
XLogP3.30
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.30
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-(3,3,3-trifluoropropyl)imidazolidin-4-one?
The IUPAC name of 2-cyclopentyl-5-(2-methylpropyl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one (CID 83250189) is 2-cyclopentyl-5-(2-methylpropyl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one.
What is the SMILES notation for 2-cyclopentyl-5-(2-methylpropyl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one?
The canonical SMILES for 2-cyclopentyl-5-(2-methylpropyl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one is CC(C)CC1NC(C2CCCC2)N(CCC(F)(F)F)C1=O.
What is the InChIKey of 2-cyclopentyl-5-(2-methylpropyl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one?
The InChIKey is USJYRTGYACUMRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25F3N2O/c1-10(2)9-12-14(21)20(8-7-15(16,17)18)13(19-12)11-5-3-4-6-11/h10-13,19H,3-9H2,1-2H3.
What are the key properties of 2-cyclopentyl-5-(2-methylpropyl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one?
2-cyclopentyl-5-(2-methylpropyl)-3-(3,3,3-trifluoropropyl)imidazolidin-4-one has a molecular weight of 306.37 g/mol, XLogP of 3.30, 5 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-(3,3,3-trifluoropropyl)imidazolidin-4-one is sourced from PubChem (CID 83250189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).