5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one

C14H26N2O2 — CID 83260746

IUPAC5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one
SMILESCCC1(C)NC(C(C)C)N(C2CCOC2C)C1=O
InChIInChI=1S/C14H26N2O2/c1-6-14(5)13(17)16(12(15-14)9(2)3)11-7-8-18-10(11)4/h9-12,15H,6-8H2,1-5H3
InChIKeyNZWNTGUMFFGKAU-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.75
Rot. Bonds3

About 5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one

5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one (PubChem CID 83260746) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one
PubChem CID83260746
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one
SMILESCCC1(C)NC(C(C)C)N(C2CCOC2C)C1=O
InChIInChI=1S/C14H26N2O2/c1-6-14(5)13(17)16(12(15-14)9(2)3)11-7-8-18-10(11)4/h9-12,15H,6-8H2,1-5H3
InChIKeyNZWNTGUMFFGKAU-UHFFFAOYSA-N
XLogP1.75
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one?
The IUPAC name of 5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one (CID 83260746) is 5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one is CCC1(C)NC(C(C)C)N(C2CCOC2C)C1=O.
What is the InChIKey of 5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one?
The InChIKey is NZWNTGUMFFGKAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-6-14(5)13(17)16(12(15-14)9(2)3)11-7-8-18-10(11)4/h9-12,15H,6-8H2,1-5H3.
What are the key properties of 5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one?
5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one has a molecular weight of 254.37 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-5-methyl-3-(2-methyloxolan-3-yl)-2-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 83260746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).