1-(2-ethylhexyl)imidazolidin-2-one

C11H22N2O — CID 107819225

IUPAC1-(2-ethylhexyl)imidazolidin-2-one
SMILESCCCCC(CC)CN1CCNC1=O
InChIInChI=1S/C11H22N2O/c1-3-5-6-10(4-2)9-13-8-7-12-11(13)14/h10H,3-9H2,1-2H3,(H,12,14)
InChIKeyWBZOTUJCFRNRLB-UHFFFAOYSA-N
MW198.31 g/mol
LogP2.23
Rot. Bonds6

About 1-(2-ethylhexyl)imidazolidin-2-one

1-(2-ethylhexyl)imidazolidin-2-one (PubChem CID 107819225) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-(2-ethylhexyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(2-ethylhexyl)imidazolidin-2-one
PubChem CID107819225
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-(2-ethylhexyl)imidazolidin-2-one
SMILESCCCCC(CC)CN1CCNC1=O
InChIInChI=1S/C11H22N2O/c1-3-5-6-10(4-2)9-13-8-7-12-11(13)14/h10H,3-9H2,1-2H3,(H,12,14)
InChIKeyWBZOTUJCFRNRLB-UHFFFAOYSA-N
XLogP2.23
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylhexyl)imidazolidin-2-one?
The IUPAC name of 1-(2-ethylhexyl)imidazolidin-2-one (CID 107819225) is 1-(2-ethylhexyl)imidazolidin-2-one.
What is the SMILES notation for 1-(2-ethylhexyl)imidazolidin-2-one?
The canonical SMILES for 1-(2-ethylhexyl)imidazolidin-2-one is CCCCC(CC)CN1CCNC1=O.
What is the InChIKey of 1-(2-ethylhexyl)imidazolidin-2-one?
The InChIKey is WBZOTUJCFRNRLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-5-6-10(4-2)9-13-8-7-12-11(13)14/h10H,3-9H2,1-2H3,(H,12,14).
What are the key properties of 1-(2-ethylhexyl)imidazolidin-2-one?
1-(2-ethylhexyl)imidazolidin-2-one has a molecular weight of 198.31 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylhexyl)imidazolidin-2-one is sourced from PubChem (CID 107819225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).