5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one

C11H22N2O2 — CID 67573392

IUPAC5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one
SMILESCCCCC1CNC(=O)N1CCOCC
InChIInChI=1S/C11H22N2O2/c1-3-5-6-10-9-12-11(14)13(10)7-8-15-4-2/h10H,3-9H2,1-2H3,(H,12,14)
InChIKeyJBAFYZMGNRKYHH-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.61
Rot. Bonds7

About 5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one

5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one (PubChem CID 67573392) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one.

Molecular Properties

Compound Name5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one
PubChem CID67573392
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one
SMILESCCCCC1CNC(=O)N1CCOCC
InChIInChI=1S/C11H22N2O2/c1-3-5-6-10-9-12-11(14)13(10)7-8-15-4-2/h10H,3-9H2,1-2H3,(H,12,14)
InChIKeyJBAFYZMGNRKYHH-UHFFFAOYSA-N
XLogP1.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one?
The IUPAC name of 5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one (CID 67573392) is 5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one.
What is the SMILES notation for 5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one?
The canonical SMILES for 5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one is CCCCC1CNC(=O)N1CCOCC.
What is the InChIKey of 5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one?
The InChIKey is JBAFYZMGNRKYHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-5-6-10-9-12-11(14)13(10)7-8-15-4-2/h10H,3-9H2,1-2H3,(H,12,14).
What are the key properties of 5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one?
5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one has a molecular weight of 214.31 g/mol, XLogP of 1.61, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-1-(2-ethoxyethyl)imidazolidin-2-one is sourced from PubChem (CID 67573392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).