2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one

C17H30N2O2 — CID 83244779

IUPAC2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one
SMILESCCCC1NC(C2CCCC2)N(C(C)C2CCCO2)C1=O
InChIInChI=1S/C17H30N2O2/c1-3-7-14-17(20)19(12(2)15-10-6-11-21-15)16(18-14)13-8-4-5-9-13/h12-16,18H,3-11H2,1-2H3
InChIKeyUXWOKPHPYYIWFT-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.67
Rot. Bonds5

About 2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one

2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one (PubChem CID 83244779) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one
PubChem CID83244779
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one
SMILESCCCC1NC(C2CCCC2)N(C(C)C2CCCO2)C1=O
InChIInChI=1S/C17H30N2O2/c1-3-7-14-17(20)19(12(2)15-10-6-11-21-15)16(18-14)13-8-4-5-9-13/h12-16,18H,3-11H2,1-2H3
InChIKeyUXWOKPHPYYIWFT-UHFFFAOYSA-N
XLogP2.67
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one?
The IUPAC name of 2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one (CID 83244779) is 2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one.
What is the SMILES notation for 2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one?
The canonical SMILES for 2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one is CCCC1NC(C2CCCC2)N(C(C)C2CCCO2)C1=O.
What is the InChIKey of 2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one?
The InChIKey is UXWOKPHPYYIWFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-3-7-14-17(20)19(12(2)15-10-6-11-21-15)16(18-14)13-8-4-5-9-13/h12-16,18H,3-11H2,1-2H3.
What are the key properties of 2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one?
2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one has a molecular weight of 294.44 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one is sourced from PubChem (CID 83244779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).