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

C15H28N2O2 — CID 83244533

IUPAC3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)C)N(C(C)C2CCCO2)C1=O
InChIInChI=1S/C15H28N2O2/c1-5-7-12-15(18)17(14(16-12)10(2)3)11(4)13-8-6-9-19-13/h10-14,16H,5-9H2,1-4H3
InChIKeyIFRQMVPPEMNWFR-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.14
Rot. Bonds5

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

3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one (PubChem CID 83244533) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one
PubChem CID83244533
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)C)N(C(C)C2CCCO2)C1=O
InChIInChI=1S/C15H28N2O2/c1-5-7-12-15(18)17(14(16-12)10(2)3)11(4)13-8-6-9-19-13/h10-14,16H,5-9H2,1-4H3
InChIKeyIFRQMVPPEMNWFR-UHFFFAOYSA-N
XLogP2.14
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one
CID 83243306
2-cyclopentyl-3-[1-(oxolan-2-yl)ethyl]-5-propylimidazolidin-4-one
CID 83244779
5-methyl-3-[1-(oxolan-2-yl)ethyl]-2-propan-2-ylimidazolidin-4-one
CID 83243781
3-(1-cyclopropylethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83243853
6-ethyl-1-[1-(oxolan-2-yl)ethyl]-3-propylpiperazine-2,5-dione
CID 64960557
2-methyl-5-(2-methylpropyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83243387
3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83243576
5-butan-2-yl-2-ethyl-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83243866
3-methyl-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83260226
3-(1-methylsulfonylpropan-2-yl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83264436
2-ethyl-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83244288
2-propan-2-yl-5-propyl-3-(thian-2-ylmethyl)imidazolidin-4-one
CID 83270758

Frequently Asked Questions

What is the IUPAC name of 3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one?
The IUPAC name of 3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one (CID 83244533) is 3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one.
What is the SMILES notation for 3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one?
The canonical SMILES for 3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one is CCCC1NC(C(C)C)N(C(C)C2CCCO2)C1=O.
What is the InChIKey of 3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one?
The InChIKey is IFRQMVPPEMNWFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-5-7-12-15(18)17(14(16-12)10(2)3)11(4)13-8-6-9-19-13/h10-14,16H,5-9H2,1-4H3.
What are the key properties of 3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one?
3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one has a molecular weight of 268.40 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(oxolan-2-yl)ethyl]-2-propan-2-yl-5-propylimidazolidin-4-one is sourced from PubChem (CID 83244533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).